*HEADER    HORMONE                                 12-NOV-10   2RRH              
*TITLE     NMR STRUCTURE OF VASOACTIVE INTESTINAL PEPTIDE IN METHANOL            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VIP PEPTIDES;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: VASOACTIVE INTESTINAL PEPTIDE, RESIDUES IN UNP 125-153;    
*COMPND   5 SYNONYM: INTESTINAL PEPTIDE PHV-42, INTESTINAL PEPTIDE PHM-27,       
*COMPND   6 PEPTIDE HISTIDINE METHIONINAMIDE 27, VASOACTIVE INTESTINAL PEPTIDE,  
*COMPND   7 VIP, VASOACTIVE INTESTINAL POLYPEPTIDE;                              
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: VIP;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PRESAT-VECTOR                              
*KEYWDS    PEPTIDE HORMONE, HORMONE                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.UMETSU, T.TENNO, N.GODA, T.IKEGAMI, H.HIROAKI                       
*REVDAT   1   06-APR-11 2RRH    0                                                


  7 THR  HN      7 THR  HB      3.85 #SUP  0.90  #QF  0.90
  7 THR  HB      8 ASP  HN      3.93 #SUP  0.95  #QF  0.95
 11 THR  HN     11 THR  HB      3.99 #SUP  0.95  #QF  0.95
 11 THR  HB     12 ARG  HN      4.22 #SUP  0.79  #QF  0.79
  6 PHE  QB      7 THR  HB      5.12 #SUP  0.94  #QF  0.94
 15 LYS  HA     19 VAL  HA      5.50 #SUP  0.87  #QF  0.87
 19 VAL  HA     22 TYR  QB      3.64 #SUP  0.90  #QF  0.90
 19 VAL  HA     20 LYS  QE      5.50 #SUP  0.79  #QF  0.79
 11 THR  HA     14 ARG  QB      3.76 #SUP  0.35  #QF  0.35
 11 THR  HA     11 THR  QG2     3.68 #SUP  0.67  #QF  0.67
 19 VAL  HA     23 LEU  HN      4.76 #SUP  0.91  #QF  0.91
  7 THR  HA      8 ASP  HN      3.56 #SUP  0.78  #QF  0.78
  7 THR  HA     10 TYR  QD      4.71 #SUP  0.76  #QF  0.76
  7 THR  HA     10 TYR  QB      3.80 #SUP  0.51  #QF  0.51
  7 THR  HA      7 THR  QG2     3.26 #SUP  0.94  #QF  0.94
 26 ILE  HA     26 ILE  QG2     3.32 #SUP  0.93  #QF  0.93
 10 TYR  HA     10 TYR  QD      4.11 #SUP  0.85  #QF  0.85
 22 TYR  HA     22 TYR  QE      4.70 #SUP  0.88  #QF  0.88
 25 SER  HA     29 GLY  HN      4.60 #SUP  0.98  #QF  0.98
 20 LYS  HA     20 LYS  QD      4.69 #SUP  0.75  #QF  0.75
 20 LYS  HA     20 LYS  QG      3.83 #SUP  0.95  #QF  0.93
 20 LYS  HA     23 LEU  HG      4.33 #SUP  0.95  #QF  0.93
 15 LYS  HA     15 LYS  QG      3.62 #SUP  0.73  #QF  0.73
 20 LYS  HA     23 LEU  QQD     3.78 #SUP  0.56  #QF  0.56
 16 GLN  HA     16 GLN  HG2     4.01 #SUP  0.99  #QF  0.99
 16 GLN  HA     19 VAL  HN      3.79 #SUP  0.26  #QF  0.26
 13 LEU  HA     16 GLN  HN      3.91 #SUP  0.42  #QF  0.42
 13 LEU  HA     17 MET  HN      4.70 #SUP  0.85  #QF  0.85
 17 MET  HA     17 MET  HG3     4.24 #SUP  0.84  #QF  0.84
 13 LEU  HA     13 LEU  QQD     3.32 #SUP  0.95  #QF  0.95
 17 MET  HA     20 LYS  QB      4.30 #SUP  0.28  #QF  0.28
 23 LEU  HA     23 LEU  HG      3.97 #SUP  0.92  #QF  0.92
 23 LEU  HA     23 LEU  QQD     3.33 #SUP  0.94  #QF  0.94
 23 LEU  HA     26 ILE  QD1     4.17 #SUP  0.62  #QF  0.62
  9 ASN  HA     12 ARG  HN      4.71 #SUP  0.91  #QF  0.91
  9 ASN  HA     12 ARG  QB      3.91 #SUP  0.75  #QF  0.75
 18 ALA  HA     21 LYS  QB      3.35 #SUP  0.49  #QF  0.49
 17 MET  QB     18 ALA  HA      4.24 #SUP  0.82  #QF  0.82
 27 LEU  HA     27 LEU  HG      3.56 #SUP  0.95  #QF  0.95
  8 ASP  HN      8 ASP  QB      3.86 #SUP  0.89  #QF  0.89
 19 VAL  HN     20 LYS  QE      5.26 #SUP  0.89  #QF  0.58
 20 LYS  QE     21 LYS  HN      5.50 #SUP  0.89  #QF  0.58
 15 LYS  QE     19 VAL  HN      5.50 #SUP  0.73  #QF  0.73
 20 LYS  HN     20 LYS  QE      4.82 #SUP  0.63  #QF  0.63
 17 MET  QB     20 LYS  QE      4.51 #SUP  0.35  #QF  0.35
 20 LYS  QB     20 LYS  QE      3.89 #SUP  0.95  #QF  0.87
 20 LYS  QG     20 LYS  QE      3.97 #SUP  0.92  #QF  0.68
 21 LYS  QG     21 LYS  QE      4.18 #SUP  0.92  #QF  0.68
 20 LYS  QE     23 LEU  QQD     5.26 #SUP  0.24  #QF  0.24
 24 ASN  HA     27 LEU  QB      4.60 #SUP  0.72  #QF  0.72
  5 VAL  HA      8 ASP  QB      4.34 #SUP  0.59  #QF  0.59
  6 PHE  QB      8 ASP  QB      5.50 #SUP  0.31  #QF  0.31
 21 LYS  QB     24 ASN  QB      4.75 #SUP  0.69  #QF  0.69
 21 LYS  QD     24 ASN  QB      4.67 #SUP  0.64  #QF  0.64
 23 LEU  QQD    24 ASN  QB      5.48 #SUP  0.61  #QF  0.28
 24 ASN  QB     27 LEU  QQD     5.50 #SUP  0.61  #QF  0.28
 21 LYS  QG     24 ASN  QB      5.04 #SUP  0.80  #QF  0.73
 23 LEU  HG     24 ASN  QB      5.50 #SUP  0.80  #QF  0.73
 22 TYR  HA     26 ILE  HB      5.50 #SUP  0.71  #QF  0.71
 16 GLN  HA     16 GLN  HG3     4.01 #SUP  0.83  #QF  0.83
 16 GLN  HG2    17 MET  HN      5.21 #SUP  0.99  #QF  0.99
 16 GLN  HG3    17 MET  HN      5.21 #SUP  0.95  #QF  0.95
 17 MET  HA     17 MET  HG2     4.24 #SUP  0.69  #QF  0.69
 14 ARG  HA     17 MET  HG2     5.06 #SUP  0.80  #QF  0.80
 13 LEU  HG     17 MET  HG2     5.01 #SUP  0.58  #QF  0.27
 15 LYS  HN     15 LYS  QB      3.01 #SUP  0.86  #QF  0.81
 20 LYS  QB     23 LEU  HN      5.50 #SUP  0.99  #QF  0.93
 21 LYS  QB     23 LEU  HN      5.50 #SUP  0.99  #QF  0.93
  5 VAL  HB      6 PHE  HN      4.09 #SUP  0.99  #QF  0.99
 16 GLN  HA     19 VAL  HB      3.74 #SUP  0.27  #QF  0.27
 21 LYS  QB     22 TYR  QB      4.38 #SUP  0.94  #QF  0.94
 20 LYS  QB     23 LEU  QQD     4.46 #SUP  0.64  #QF  0.64
 20 LYS  QB     20 LYS  QD      3.15 #SUP  0.80  #QF  0.80
 13 LEU  QQD    16 GLN  HB3     4.81 #SUP  0.69  #QF  0.69
 13 LEU  HG     16 GLN  HB3     5.50 #SUP  0.83  #QF  0.83
 13 LEU  HG     16 GLN  HB2     5.50 #SUP  0.48  #QF  0.48
 13 LEU  QQD    16 GLN  HB2     4.81 #SUP  0.34  #QF  0.34
 16 GLN  HN     16 GLN  HB2     3.89 #SUP  0.82  #QF  0.82
 16 GLN  HB2    17 MET  HN      4.02 #SUP  0.87  #QF  0.87
 12 ARG  HN     12 ARG  QG      4.30 #SUP  0.94  #QF  0.94
 26 ILE  HN     26 ILE  HG13    3.92 #SUP  0.86  #QF  0.86
 15 LYS  HN     15 LYS  QG      4.20 #SUP  0.60  #QF  0.60
 24 ASN  HA     27 LEU  QQD     4.35 #SUP  0.61  #QF  0.61
 23 LEU  QB     23 LEU  QQD     2.94 #SUP  0.68  #QF  0.68
 13 LEU  QB     13 LEU  QQD     2.55 #SUP  0.61  #QF  0.61
 18 ALA  QB     19 VAL  QG2     3.87 #SUP  0.90  #QF  0.90
 19 VAL  QG2    22 TYR  QB      4.38 #SUP  0.90  #QF  0.90
 16 GLN  HA     19 VAL  QG2     3.51 #SUP  0.69  #QF  0.69
 19 VAL  HA     19 VAL  QG2     3.08 #SUP  0.93  #QF  0.93
 19 VAL  HN     19 VAL  QG2     2.99 #SUP  0.95  #QF  0.95
 19 VAL  QG2    23 LEU  HN      5.50 #SUP  0.22  #QF  0.22
  7 THR  QG2     8 ASP  HA      3.79 #SUP  0.82  #QF  0.82
  6 PHE  QD      7 THR  QG2     5.48 #SUP  0.69  #QF  0.69
  7 THR  QG2    10 TYR  QD      4.96 #SUP  0.67  #QF  0.67
  7 THR  QG2    10 TYR  QE      5.50 #SUP  0.77  #QF  0.77
  7 THR  QG2     8 ASP  HN      3.44 #SUP  0.70  #QF  0.70
  5 VAL  HN      5 VAL  QG2     3.84 #SUP  0.81  #QF  0.81
  5 VAL  QG1     6 PHE  HA      4.56 #SUP  0.67  #QF  0.67
  4 ALA  QB      5 VAL  QG2     5.01 #SUP  0.55  #QF  0.55
 19 VAL  QG1    20 LYS  QB      4.21 #SUP  0.96  #QF  0.96
 19 VAL  QG1    20 LYS  QG      4.34 #SUP  0.73  #QF  0.53
 19 VAL  QG1    23 LEU  HG      4.58 #SUP  0.73  #QF  0.53
 19 VAL  QG1    22 TYR  QB      4.50 #SUP  0.90  #QF  0.90
  5 VAL  HA      5 VAL  QG2     3.45 #SUP  0.93  #QF  0.93
 19 VAL  QG1    20 LYS  HA      3.57 #SUP  0.90  #QF  0.90
 19 VAL  HA     19 VAL  QG1     3.35 #SUP  0.97  #QF  0.97
  5 VAL  QG2     6 PHE  HA      4.56 #SUP  0.85  #QF  0.85
 19 VAL  QG1    23 LEU  HN      4.53 #SUP  0.96  #QF  0.96
  4 ALA  QB      5 VAL  QG1     5.01 #SUP  0.91  #QF  0.91
  3 ASP  QB      4 ALA  QB      5.07 #SUP  0.59  #QF  0.43
  4 ALA  QB      8 ASP  QB      5.29 #SUP  0.59  #QF  0.43
  4 ALA  QB      6 PHE  QB      5.50 #SUP  0.72  #QF  0.72
  4 ALA  QB      5 VAL  HA      4.34 #SUP  0.96  #QF  0.96
  3 ASP  HA      4 ALA  QB      4.84 #SUP  0.61  #QF  0.61
  4 ALA  QB      6 PHE  HN      4.72 #SUP  0.73  #QF  0.73
 26 ILE  QG2    27 LEU  HA      4.18 #SUP  0.52  #QF  0.52
 17 MET  QB     18 ALA  QB      4.20 #SUP  0.40  #QF  0.40
 18 ALA  QB     21 LYS  QB      4.01 #SUP  0.37  #QF  0.37
 26 ILE  HB     26 ILE  QD1     3.34 #SUP  0.92  #QF  0.92
 26 ILE  QD1    27 LEU  HG      5.24 #SUP  0.68  #QF  0.68
 22 TYR  QB     26 ILE  QD1     4.76 #SUP  0.72  #QF  0.72
 22 TYR  HA     26 ILE  QD1     4.92 #SUP  0.87  #QF  0.87
 22 TYR  QD     26 ILE  QD1     4.81 #SUP  0.64  #QF  0.64
 26 ILE  HN     26 ILE  QD1     4.11 #SUP  0.96  #QF  0.96
  7 THR  HA      8 ASP  HA      5.00 #SUP  0.67  #QF  0.67
  5 VAL  HA      5 VAL  QG1     3.45 #SUP  0.97  #QF  0.97
 25 SER  HA     25 SER  QB      3.00 #SUP  0.97  #QF  0.97
 25 SER  QB     26 ILE  HN      4.09 #SUP  0.90  #QF  0.90
 25 SER  HN     25 SER  QB      3.40 #SUP  0.93  #QF  0.93
 26 ILE  HA     26 ILE  QD1     3.97 #SUP  0.97  #QF  0.97
 10 TYR  HA     13 LEU  QB      3.54 #SUP  0.70  #QF  0.70
 10 TYR  HA     13 LEU  QQD     4.04 #SUP  0.62  #QF  0.62
 10 TYR  HA     10 TYR  QE      4.58 #SUP  0.88  #QF  0.88
 10 TYR  HA     14 ARG  HN      4.99 #SUP  0.92  #QF  0.92
 23 LEU  HA     26 ILE  HN      4.81 #SUP  0.88  #QF  0.88
 23 LEU  HA     27 LEU  QB      5.29 #SUP  0.43  #QF  0.43
 19 VAL  QG1    23 LEU  HA      5.50 #SUP  0.81  #QF  0.30
 12 ARG  HA     12 ARG  QD      4.30 #SUP  0.86  #QF  0.86
  9 ASN  HA     12 ARG  QD      4.10 #SUP  0.53  #QF  0.53
 12 ARG  HN     12 ARG  QD      4.56 #SUP  0.92  #QF  0.92
 14 ARG  QB     14 ARG  QD      3.36 #SUP  0.87  #QF  0.87
 14 ARG  QD     18 ALA  QB      4.13 #SUP  0.79  #QF  0.79
 12 ARG  QB     12 ARG  QD      3.72 #SUP  0.98  #QF  0.98
 12 ARG  HN     12 ARG  QB      3.66 #SUP  0.98  #QF  0.98
 12 ARG  HA     12 ARG  QG      4.20 #SUP  0.88  #QF  0.88
 14 ARG  HA     17 MET  HN      4.26 #SUP  0.95  #QF  0.95
 14 ARG  HA     14 ARG  QD      4.15 #SUP  0.97  #QF  0.97
 14 ARG  HA     17 MET  QB      3.94 #SUP  0.75  #QF  0.75
 13 LEU  HG     14 ARG  HA      4.13 #SUP  0.96  #QF  0.96
 14 ARG  HA     14 ARG  QG      3.96 #SUP  0.99  #QF  0.99
 13 LEU  QQD    14 ARG  HA      4.40 #SUP  0.97  #QF  0.97
 14 ARG  HA     17 MET  HG3     5.06 #SUP  0.97  #QF  0.97
 14 ARG  QB     17 MET  HN      5.15 #SUP  0.95  #QF  0.95
 14 ARG  QB     15 LYS  HN      3.79 #SUP  0.59  #QF  0.59
 13 LEU  HA     14 ARG  QB      5.25 #SUP  0.94  #QF  0.94
 14 ARG  QB     17 MET  QB      5.41 #SUP  0.87  #QF  0.87
 14 ARG  QB     18 ALA  QB      4.01 #SUP  0.80  #QF  0.80
 14 ARG  QG     18 ALA  QB      3.82 #SUP  0.73  #QF  0.73
 14 ARG  QG     15 LYS  HN      4.95 #SUP  0.90  #QF  0.90
 15 LYS  HA     15 LYS  QE      3.64 #SUP  0.97  #QF  0.97
 15 LYS  HA     15 LYS  QD      3.16 #SUP  0.79  #QF  0.79
 15 LYS  HA     19 VAL  QG2     4.85 #SUP  1.00
 15 LYS  HA     18 ALA  HN      3.92 #SUP  0.98  #QF  0.98
 14 ARG  HN     15 LYS  QB      4.47 #SUP  0.69  #QF  0.69
 15 LYS  QB     16 GLN  HN      3.10 #SUP  0.86  #QF  0.86
 21 LYS  QB     22 TYR  HN      3.07 #SUP  0.71  #QF  0.71
 15 LYS  QB     15 LYS  QE      4.12 #SUP  0.91  #QF  0.91
 15 LYS  QB     15 LYS  QD      2.91 #SUP  0.85  #QF  0.85
 15 LYS  QG     15 LYS  QD      2.64 #SUP  0.88  #QF  0.88
 15 LYS  QG     16 GLN  HA      3.99 #SUP  0.58  #QF  0.58
 15 LYS  HN     15 LYS  QD      4.84 #SUP  1.00
  7 THR  HN      7 THR  QG2     3.56 #SUP  1.00
  6 PHE  HN      7 THR  QG2     4.10 #SUP  0.92  #QF  0.92
  6 PHE  QB      7 THR  QG2     4.10 #SUP  0.93  #QF  0.93
  8 ASP  QB      9 ASN  HA      4.70 #SUP  0.77  #QF  0.77
  8 ASP  QB      9 ASN  HN      4.52 #SUP  0.93  #QF  0.93
 13 LEU  QB     14 ARG  HA      4.74 #SUP  0.34  #QF  0.34
 13 LEU  HA     13 LEU  HG      4.09 #SUP  0.98  #QF  0.98
 13 LEU  HN     13 LEU  HG      4.58 #SUP  0.97  #QF  0.97
 13 LEU  HG     17 MET  HG3     5.01 #SUP  0.92  #QF  0.92
 15 LYS  HA     18 ALA  QB      3.09 #SUP  0.96  #QF  0.96
 18 ALA  QB     19 VAL  HA      4.32 #SUP  0.98  #QF  0.98
 18 ALA  QB     22 TYR  QB      5.05 #SUP  0.98  #QF  0.98
 15 LYS  QE     19 VAL  QG2     4.34 #SUP  0.83  #QF  0.83
 15 LYS  QB     19 VAL  QG2     4.19 #SUP  0.84  #QF  0.84
 19 VAL  HN     19 VAL  QG1     3.68 #SUP  1.00
 19 VAL  QG1    20 LYS  HN      3.48 #SUP  0.97  #QF  0.97
 21 LYS  HA     21 LYS  QD      4.00 #SUP  0.51  #QF  0.51
 20 LYS  HN     20 LYS  QD      4.08 #SUP  0.76  #QF  0.76
 20 LYS  QD     21 LYS  HN      4.97 #SUP  0.83  #QF  0.22
 21 LYS  HN     21 LYS  QD      4.81 #SUP  0.83  #QF  0.22
 21 LYS  HA     21 LYS  QE      4.43 #SUP  0.74  #QF  0.74
 20 LYS  HA     23 LEU  QB      4.14 #SUP  0.80  #QF  0.80
 21 LYS  HA     24 ASN  QB      3.73 #SUP  0.66  #QF  0.66
 23 LEU  HN     24 ASN  HN      3.60 #SUP  0.99  #QF  0.99
 11 THR  HN     12 ARG  HN      3.60 #SUP  0.78  #QF  0.78
 10 TYR  QD     11 THR  HN      4.60 #SUP  0.86  #QF  0.86
 10 TYR  QB     11 THR  HN      3.87 #SUP  0.82  #QF  0.82
 20 LYS  HA     24 ASN  HN      4.43 #SUP  0.83  #QF  0.83
 24 ASN  HN     24 ASN  QB      3.20 #SUP  0.96  #QF  0.96
 23 LEU  QQD    24 ASN  HN      4.43 #SUP  0.99  #QF  0.99
 23 LEU  QB     24 ASN  HN      3.75 #SUP  0.50  #QF  0.50
 28 ASN  HN     28 ASN  HB3     3.78 #SUP  0.98  #QF  0.98
 27 LEU  QQD    28 ASN  HN      4.32 #SUP  0.90  #QF  0.90
 27 LEU  QB     28 ASN  HN      3.77 #SUP  0.95  #QF  0.95
  5 VAL  HN      5 VAL  QG1     3.84 #SUP  0.97  #QF  0.97
  4 ALA  QB      5 VAL  HN      3.50 #SUP  0.90  #QF  0.90
  5 VAL  HN      5 VAL  HB      3.24 #SUP  0.98  #QF  0.98
  5 VAL  HN      8 ASP  QB      4.63 #SUP  0.54  #QF  0.54
  5 VAL  HN      6 PHE  QB      4.74 #SUP  0.71  #QF  0.71
  4 ALA  HN      5 VAL  HN      3.74 #SUP  0.97  #QF  0.97
 19 VAL  HA     21 LYS  HN      4.72 #SUP  0.85  #QF  0.85
 21 LYS  HN     22 TYR  QB      4.59 #SUP  0.73  #QF  0.73
 21 LYS  HN     21 LYS  QB      2.99 #SUP  0.92  #QF  0.48
  5 VAL  HN      6 PHE  HN      3.24 #SUP  0.98  #QF  0.98
  6 PHE  HN      6 PHE  QD      4.24 #SUP  0.84  #QF  0.84
  6 PHE  HN      6 PHE  QE      4.49 #SUP  0.75  #QF  0.75
  6 PHE  HN      6 PHE  QB      3.04 #SUP  0.90  #QF  0.90
  4 ALA  HN      4 ALA  QB      3.21 #SUP  0.97  #QF  0.97
  3 ASP  HN      3 ASP  QB      4.11 #SUP  0.96  #QF  0.96
  5 VAL  HA      8 ASP  HN      4.80 #SUP  0.98  #QF  0.98
 18 ALA  HN     19 VAL  HN      3.30 #SUP  0.84  #QF  0.84
 18 ALA  HN     18 ALA  QB      2.91 #SUP  0.98  #QF  0.98
 18 ALA  HN     19 VAL  QG2     4.80 #SUP  0.98  #QF  0.98
 22 TYR  HN     22 TYR  QE      4.77 #SUP  0.95  #QF  0.95
 10 TYR  HN     12 ARG  HN      4.29 #SUP  0.59  #QF  0.59
 10 TYR  HN     10 TYR  QE      4.42 #SUP  0.90  #QF  0.90
 27 LEU  HN     28 ASN  HN      3.46 #SUP  0.93  #QF  0.93
 27 LEU  HN     27 LEU  QB      3.14 #SUP  0.92  #QF  0.92
 22 TYR  HN     22 TYR  QB      3.10 #SUP  0.96  #QF  0.96
 13 LEU  HN     13 LEU  QB      2.97 #SUP  0.92  #QF  0.92
 12 ARG  QB     13 LEU  HN      3.30 #SUP  0.53  #QF  0.22
  7 THR  QG2    10 TYR  HN      5.01 #SUP  0.58  #QF  0.58
 22 TYR  QD     23 LEU  HN      4.34 #SUP  0.51  #QF  0.51
 22 TYR  QB     23 LEU  HN      3.61 #SUP  0.98  #QF  0.98
 23 LEU  HN     23 LEU  HG      3.82 #SUP  0.94  #QF  0.94
 20 LYS  HN     20 LYS  QB      3.02 #SUP  0.79  #QF  0.79
 18 ALA  QB     19 VAL  HN      3.22 #SUP  0.82  #QF  0.82
 19 VAL  HN     19 VAL  HB      3.26 #SUP  0.97  #QF  0.97
 14 ARG  HN     14 ARG  QB      3.15 #SUP  0.94  #QF  0.94
 24 ASN  HN     26 ILE  HN      4.53 #SUP  0.95  #QF  0.95
 24 ASN  QB     26 ILE  HN      4.93 #SUP  0.51  #QF  0.51
 26 ILE  HN     26 ILE  QG2     3.83 #SUP  0.94  #QF  0.94
 26 ILE  HN     26 ILE  HG12    3.92 #SUP  1.00
 26 ILE  HN     26 ILE  HB      3.55 #SUP  0.98  #QF  0.98
 16 GLN  HB3    17 MET  HN      4.02 #SUP  0.97  #QF  0.57
 17 MET  HN     17 MET  QB      3.76 #SUP  0.97  #QF  0.57
 13 LEU  QQD    17 MET  HN      4.83 #SUP  0.98  #QF  0.98
 14 ARG  HN     15 LYS  HN      3.17 #SUP  0.54  #QF  0.54
 14 ARG  HN     14 ARG  QD      4.58 #SUP  0.68  #QF  0.68
 16 GLN  HN     16 GLN  HB3     3.89 #SUP  0.99  #QF  0.99
 24 ASN  HN     25 SER  HN      3.51 #SUP  0.97  #QF  0.97
 23 LEU  HN     25 SER  HN      4.74 #SUP  0.88  #QF  0.88
 24 ASN  QB     25 SER  HN      3.78 #SUP  0.93  #QF  0.93
  7 THR  HN      8 ASP  HN      3.83 #SUP  0.93  #QF  0.93
  6 PHE  QD      7 THR  HN      4.80 #SUP  0.55  #QF  0.55
  6 PHE  QB      7 THR  HN      3.63 #SUP  0.91  #QF  0.91
  7 THR  HN     10 TYR  QB      5.50 #SUP  0.79  #QF  0.79
  5 VAL  HA      7 THR  HN      4.99 #SUP  0.74  #QF  0.74
 28 ASN  HN     29 GLY  HN      3.06 #SUP  0.95  #QF  0.95
 26 ILE  HA     29 GLY  HN      4.70 #SUP  0.60  #QF  0.60
 29 GLY  HN     29 GLY  QA      2.89 #SUP  0.95  #QF  0.95
 27 LEU  HA     29 GLY  HN      4.35 #SUP  0.95  #QF  0.95
 28 ASN  HB3    29 GLY  HN      4.27 #SUP  0.98  #QF  0.98
 28 ASN  HB2    29 GLY  HN      4.27 #SUP  0.97  #QF  0.97
 27 LEU  QB     29 GLY  HN      4.60 #SUP  0.96  #QF  0.96
 26 ILE  QG2    29 GLY  HN      4.78 #SUP  0.54  #QF  0.54
 27 LEU  QQD    29 GLY  HN      5.44 #SUP  0.96  #QF  0.96
  5 VAL  HN      7 THR  HN      4.63 #SUP  0.93  #QF  0.93
  4 ALA  HA      7 THR  HN      4.17 #SUP  0.59  #QF  0.59
 25 SER  HN     26 ILE  HN      3.51 #SUP  0.87  #QF  0.87
 22 TYR  HA     25 SER  HN      4.13 #SUP  0.58  #QF  0.58
 25 SER  HN     26 ILE  HB      4.78 #SUP  0.87  #QF  0.87
 25 SER  HA     28 ASN  HN      4.09 #SUP  0.64  #QF  0.64
 25 SER  QB     28 ASN  HN      5.46 #SUP  0.67  #QF  0.67
 28 ASN  HN     29 GLY  QA      4.94 #SUP  0.88  #QF  0.88
 28 ASN  HN     28 ASN  HB2     3.78 #SUP  0.92  #QF  0.92
 27 LEU  HG     28 ASN  HN      4.80 #SUP  0.90  #QF  0.90
 23 LEU  HG     24 ASN  HN      4.83 #SUP  0.80  #QF  0.80
  9 ASN  HA     11 THR  HN      4.72 #SUP  0.51  #QF  0.51
 11 THR  HN     14 ARG  QB      4.82 #SUP  0.53  #QF  0.53
 11 THR  HN     11 THR  QG2     3.99 #SUP  0.90  #QF  0.90
 16 GLN  HN     17 MET  HN      3.34 #SUP  0.93  #QF  0.93
 17 MET  HN     18 ALA  HN      3.40 #SUP  0.94  #QF  0.94
 17 MET  HN     17 MET  HG3     3.75 #SUP  0.95  #QF  0.95
 17 MET  HN     17 MET  HG2     3.75 #SUP  0.93  #QF  0.93
 15 LYS  QB     17 MET  HN      4.92 #SUP  0.39  #QF  0.39
 17 MET  HN     18 ALA  QB      4.36 #SUP  0.94  #QF  0.94
 13 LEU  HG     17 MET  HN      4.29 #SUP  0.91  #QF  0.91
 16 GLN  HN     16 GLN  HG2     3.96 #SUP  0.78  #QF  0.78
 13 LEU  HG     14 ARG  HN      3.89 #SUP  0.96  #QF  0.96
 13 LEU  QB     14 ARG  HN      3.26 #SUP  0.87  #QF  0.87
 14 ARG  HN     14 ARG  QG      4.13 #SUP  0.95  #QF  0.95
 13 LEU  QQD    14 ARG  HN      4.20 #SUP  0.96  #QF  0.96
 15 LYS  HN     16 GLN  HN      3.33 #SUP  0.57  #QF  0.57
 16 GLN  HN     19 VAL  QG2     4.70 #SUP  0.80  #QF  0.80
 13 LEU  QQD    16 GLN  HN      5.03 #SUP  0.79  #QF  0.79
 16 GLN  HN     16 GLN  HG3     3.96 #SUP  0.80  #QF  0.80
 21 LYS  HN     23 LEU  HN      4.84 #SUP  0.80  #QF  0.80
 20 LYS  HN     21 LYS  HN      2.86 #SUP  0.48  #QF  0.48
 21 LYS  HN     22 TYR  HN      2.85 #SUP  0.81  #QF  0.81
 18 ALA  HA     21 LYS  HN      3.85 #SUP  0.63  #QF  0.63
 19 VAL  HN     20 LYS  HN      2.84 #SUP  0.66  #QF  0.66
 15 LYS  HA     19 VAL  HN      4.16 #SUP  0.96  #QF  0.96
 19 VAL  HN     22 TYR  QB      5.16 #SUP  0.98  #QF  0.98
 22 TYR  HN     23 LEU  HN      3.48 #SUP  0.99  #QF  0.99
 20 LYS  HA     23 LEU  HN      4.09 #SUP  1.00
 23 LEU  HN     24 ASN  QB      4.71 #SUP  0.91  #QF  0.91
 23 LEU  HN     23 LEU  QB      3.21 #SUP  0.75  #QF  0.75
 23 LEU  HN     23 LEU  QQD     3.32 #SUP  0.97  #QF  0.97
 26 ILE  HN     27 LEU  HN      3.30 #SUP  0.80  #QF  0.80
 24 ASN  HN     27 LEU  HN      5.20 #SUP  0.84  #QF  0.84
 24 ASN  HA     27 LEU  HN      4.73 #SUP  0.79  #QF  0.79
 26 ILE  HB     27 LEU  HN      3.64 #SUP  0.86  #QF  0.86
 27 LEU  HN     27 LEU  HG      3.80 #SUP  0.79  #QF  0.79
 27 LEU  HN     27 LEU  QQD     3.45 #SUP  0.74  #QF  0.74
 23 LEU  QQD    27 LEU  HN      4.58 #SUP  0.46  #QF  0.46
 26 ILE  QG2    27 LEU  HN      3.62 #SUP  0.80  #QF  0.80
 26 ILE  QD1    27 LEU  HN      4.51 #SUP  0.87  #QF  0.87
 19 VAL  HB     20 LYS  HN      3.56 #SUP  0.90  #QF  0.90
 17 MET  HA     20 LYS  HN      4.39 #SUP  0.80  #QF  0.72
 18 ALA  HA     20 LYS  HN      4.98 #SUP  0.80  #QF  0.72
 20 LYS  HN     23 LEU  HN      4.93 #SUP  0.91  #QF  0.91
 17 MET  HN     20 LYS  HN      5.28 #SUP  0.60  #QF  0.60
  6 PHE  HN      8 ASP  HN      4.05 #SUP  0.83  #QF  0.83
  6 PHE  HN      8 ASP  QB      4.52 #SUP  0.41  #QF  0.41
  5 VAL  QG1     6 PHE  HN      3.67 #SUP  0.92  #QF  0.92
  5 VAL  QG2     6 PHE  HN      3.67 #SUP  0.92  #QF  0.92
 13 LEU  HN     14 ARG  HN      3.23 #SUP  0.86  #QF  0.86
 11 THR  HN     13 LEU  HN      4.45 #SUP  0.84  #QF  0.84
 10 TYR  HA     13 LEU  HN      3.63 #SUP  0.97  #QF  0.97
 10 TYR  QB     13 LEU  HN      5.02 #SUP  0.87  #QF  0.87
 13 LEU  HN     13 LEU  QQD     3.73 #SUP  0.99  #QF  0.99
 21 LYS  QG     22 TYR  HN      4.43 #SUP  0.86  #QF  0.86
  6 PHE  HA     10 TYR  HN      4.79 #SUP  0.84  #QF  0.84
 10 TYR  HN     10 TYR  QB      3.39 #SUP  0.90  #QF  0.90
  9 ASN  HB2    10 TYR  HN      4.11 #SUP  0.93  #QF  0.93
  9 ASN  HB3    10 TYR  HN      4.11 #SUP  0.96  #QF  0.96
 17 MET  HG3    18 ALA  HN      4.83 #SUP  0.75  #QF  0.75
 17 MET  HG2    18 ALA  HN      4.83 #SUP  0.75  #QF  0.75
 17 MET  QB     18 ALA  HN      3.52 #SUP  0.70  #QF  0.70
 18 ALA  HN     19 VAL  HB      4.58 #SUP  0.60  #QF  0.60
 15 LYS  QB     18 ALA  HN      5.50 #SUP  0.87  #QF  0.68
 18 ALA  HN     21 LYS  QB      5.50 #SUP  0.87  #QF  0.68
 14 ARG  QG     18 ALA  HN      4.85 #SUP  0.56  #QF  0.56
 18 ALA  HN     19 VAL  QG1     5.50 #SUP  0.32  #QF  0.32
  8 ASP  HN      9 ASN  HN      4.09 #SUP  0.78  #QF  0.78
  3 ASP  HN      4 ALA  HN      4.53 #SUP  0.63  #QF  0.63
  3 ASP  QB      4 ALA  HN      4.19 #SUP  0.59  #QF  0.59
 22 TYR  HN     22 TYR  QD      3.75 #SUP  0.89  #QF  0.89
 18 ALA  HA     22 TYR  QD      4.15 #SUP  0.44  #QF  0.44
 10 TYR  HN     10 TYR  QD      3.70 #SUP  0.59  #QF  0.59
 10 TYR  QD     13 LEU  QB      4.45 #SUP  0.26  #QF  0.26
 18 ALA  QB     22 TYR  QD      4.62 #SUP  0.87  #QF  0.87
  4 ALA  HN      5 VAL  QQG     4.54 
  4 ALA  QB      5 VAL  QQG     4.02 
  5 VAL  HN      5 VAL  QQG     2.94 
  5 VAL  HA      5 VAL  QQG     3.01 
  5 VAL  QQG     6 PHE  QB      4.76 
  5 VAL  QQG     7 THR  HN      5.16 
  5 VAL  QQG     7 THR  QG2     5.05 
  5 VAL  QQG     8 ASP  HN      5.06 
  5 VAL  QQG     9 ASN  QB      4.35 
  5 VAL  QQG     9 ASN  QD2     4.38 
  6 PHE  HA      9 ASN  QB      3.56 
  9 ASN  HN      9 ASN  QB      3.57 
  9 ASN  QB     10 TYR  HN      3.57 
 13 LEU  HG     16 GLN  QB      4.76 
 13 LEU  HG     17 MET  QG      4.30 
 13 LEU  QQD    16 GLN  QB      4.03 
 13 LEU  QQD    16 GLN  QG      5.13 
 13 LEU  QQD    17 MET  QG      4.41 
 14 ARG  HN     17 MET  QG      5.24 
 14 ARG  HA     17 MET  QG      4.36 
 16 GLN  HN     16 GLN  QB      3.29 
 16 GLN  HN     16 GLN  QG      3.44 
 16 GLN  HA     16 GLN  QG      3.52 
 16 GLN  QB     17 MET  HN      3.30 
 16 GLN  QG     17 MET  HN      4.57 
 16 GLN  QG     19 VAL  QG2     4.76 
 16 GLN  QE2    19 VAL  QG1     4.49 
 16 GLN  QE2    19 VAL  QG2     4.67 
 17 MET  HA     17 MET  QG      3.56 
 17 MET  QG     18 ALA  QB      5.34 
 21 LYS  HA     24 ASN  QD2     4.82 
 22 TYR  QB     26 ILE  QG1     5.27 
 23 LEU  HA     26 ILE  QG1     4.07 
 24 ASN  QD2    25 SER  HN      3.60 
 26 ILE  HN     26 ILE  QG1     3.42 
 26 ILE  HA     26 ILE  QG1     3.63 
 26 ILE  QG2    26 ILE  QG1     3.39 
 26 ILE  QG1    27 LEU  HN      4.69 
 27 LEU  HN     28 ASN  QB      5.15 
 28 ASN  HN     28 ASN  QB      3.32 
 28 ASN  HN     28 ASN  QD2     4.60 
# column 1: residue number
# column 2: amino acid
# column 3: angle identifier
# column 4: the angle's lower limit
# column 5: the angle's upper limit

   4 ALA   PHI    -70.79   -48.67
   4 ALA   PSI    -52.09   -36.19
   5 VAL   PHI    -69.78   -54.82
   5 VAL   PSI    -45.76   -38.52
   6 PHE   PHI    -68.69   -60.23
   6 PHE   PSI    -54.54   -40.82
   7 THR   PHI    -67.66   -52.84
   7 THR   PSI    -51.77   -38.37
   8 ASP   PHI    -67.20   -55.78
   8 ASP   PSI    -56.53   -35.63
   9 ASN   PHI    -72.19   -51.07
   9 ASN   PSI    -47.13   -27.71
  10 TYR   PHI    -73.05   -60.59
  10 TYR   PSI    -46.62   -34.04
  11 THR   PHI    -69.53   -57.99
  11 THR   PSI    -50.28   -40.56
  12 ARG   PHI    -72.91   -59.75
  12 ARG   PSI    -44.62   -33.30
  13 LEU   PHI    -71.39   -56.10
  13 LEU   PSI    -48.92   -36.60
  14 ARG   PHI    -71.25   -59.15
  14 ARG   PSI    -47.31   -36.91
  15 LYS   PHI    -66.78   -56.06
  15 LYS   PSI    -45.53   -36.59
  16 GLN   PHI    -70.43   -59.55
  16 GLN   PSI    -46.04   -35.96
  17 MET   PHI    -69.38   -56.26
  17 MET   PSI    -51.31   -32.59
  18 ALA   PHI    -72.27   -60.45
  18 ALA   PSI    -46.33   -26.53
  19 VAL   PHI    -70.93   -61.99
  19 VAL   PSI    -47.41   -38.41
  20 LYS   PHI    -65.63   -56.99
  20 LYS   PSI    -45.73   -35.91
  21 LYS   PHI    -65.46   -56.54
  21 LYS   PSI    -45.40   -36.24
  22 TYR   PHI    -71.97   -60.59
  22 TYR   PSI    -53.67   -34.81
  23 LEU   PHI    -70.46   -56.74
  23 LEU   PSI    -46.70   -31.14
  24 ASN   PHI    -72.56   -61.20
  24 ASN   PSI    -51.69   -35.53
  25 SER   PHI    -69.82   -53.78
  25 SER   PSI    -52.28   -24.10
  27 LEU   PHI    -80.48   -61.58
  27 LEU   PSI    -42.23   -19.81

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   HIS   1           H        HIS   1 -23.312   3.767   1.315
    2    HA   HIS   1           HA       HIS   1 -24.143   3.758  -1.484
    3    HB2  HIS   1           HB2      HIS   1 -25.339   5.316  -0.111
    4    HB3  HIS   1           HB3      HIS   1 -23.844   5.974   0.546
    5    HD1  HIS   1           HD1      HIS   1 -24.106   8.351  -0.250
    6    HD2  HIS   1           HD2      HIS   1 -24.486   5.572  -3.315
    7    HE1  HIS   1           HE1      HIS   1 -24.138   9.694  -2.376
    8    HE2  HIS   1           HE2      HIS   1 -24.454   7.998  -4.211
    9    H    SER   2           H        SER   2 -21.615   5.324   0.488
   10    HA   SER   2           HA       SER   2 -19.991   5.647  -1.926
   11    HB2  SER   2           HB2      SER   2 -18.670   7.220  -0.659
   12    HB3  SER   2           HB3      SER   2 -20.373   7.603  -0.403
   13    HG   SER   2           HG       SER   2 -20.269   6.721   1.613
   14    H    ASP   3           H        ASP   3 -18.440   4.244  -2.376
   15    HA   ASP   3           HA       ASP   3 -17.642   2.267  -0.422
   16    HB2  ASP   3           HB2      ASP   3 -16.106   1.626  -2.488
   17    HB3  ASP   3           HB3      ASP   3 -17.821   1.227  -2.461
   18    H    ALA   4           H        ALA   4 -16.878   4.806   0.383
   19    HA   ALA   4           HA       ALA   4 -14.216   5.464  -0.341
   20    HB1  ALA   4           HB1      ALA   4 -16.213   6.661   1.143
   21    HB2  ALA   4           HB2      ALA   4 -14.964   6.303   2.336
   22    HB3  ALA   4           HB3      ALA   4 -14.574   7.270   0.914
   23    H    VAL   5           H        VAL   5 -15.612   3.589   2.320
   24    HA   VAL   5           HA       VAL   5 -13.259   3.153   3.774
   25    HB   VAL   5           HB       VAL   5 -15.366   2.629   4.784
   26   HG11  VAL   5          HG11      VAL   5 -16.753   2.042   2.979
   27   HG12  VAL   5          HG12      VAL   5 -15.690   0.724   2.482
   28   HG13  VAL   5          HG13      VAL   5 -16.638   0.583   3.962
   29   HG21  VAL   5          HG21      VAL   5 -13.606   0.236   4.324
   30   HG22  VAL   5          HG22      VAL   5 -13.633   1.326   5.710
   31   HG23  VAL   5          HG23      VAL   5 -14.969   0.206   5.443
   32    H    PHE   6           H        PHE   6 -14.655   1.416   1.040
   33    HA   PHE   6           HA       PHE   6 -12.969  -0.819   1.067
   34    HB2  PHE   6           HB2      PHE   6 -14.587   0.554  -1.047
   35    HB3  PHE   6           HB3      PHE   6 -13.475  -0.731  -1.510
   36    HD1  PHE   6           HD1      PHE   6 -16.372   0.043   0.663
   37    HD2  PHE   6           HD2      PHE   6 -14.060  -2.978  -1.245
   38    HE1  PHE   6           HE1      PHE   6 -18.067  -1.634   1.273
   39    HE2  PHE   6           HE2      PHE   6 -15.751  -4.659  -0.639
   40    HZ   PHE   6           HZ       PHE   6 -17.758  -3.988   0.620
   41    H    THR   7           H        THR   7 -12.690   2.178  -0.843
   42    HA   THR   7           HA       THR   7 -10.149   1.540  -1.921
   43    HB   THR   7           HB       THR   7 -11.639   3.179  -2.985
   44    HG1  THR   7           HG1      THR   7  -9.071   4.066  -2.151
   45   HG21  THR   7          HG21      THR   7 -11.004   4.867  -0.563
   46   HG22  THR   7          HG22      THR   7 -12.587   4.258  -1.045
   47   HG23  THR   7          HG23      THR   7 -11.772   5.471  -2.031
   48    H    ASP   8           H        ASP   8 -11.184   3.367   0.912
   49    HA   ASP   8           HA       ASP   8  -8.745   4.519   1.618
   50    HB2  ASP   8           HB2      ASP   8 -10.444   5.360   2.907
   51    HB3  ASP   8           HB3      ASP   8 -11.236   3.796   3.074
   52    H    ASN   9           H        ASN   9 -10.088   1.344   2.438
   53    HA   ASN   9           HA       ASN   9  -7.970   0.550   4.136
   54    HB2  ASN   9           HB2      ASN   9 -10.211  -0.838   2.736
   55    HB3  ASN   9           HB3      ASN   9  -8.896  -1.820   3.375
   56   HD21  ASN   9          HD21      ASN   9  -8.661  -2.055   5.558
   57   HD22  ASN   9          HD22      ASN   9  -9.828  -1.495   6.702
   58    H    TYR  10           H        TYR  10  -8.603   0.024   0.689
   59    HA   TYR  10           HA       TYR  10  -6.375  -1.629   0.194
   60    HB2  TYR  10           HB2      TYR  10  -7.758   0.228  -1.751
   61    HB3  TYR  10           HB3      TYR  10  -6.769  -1.169  -2.158
   62    HD1  TYR  10           HD1      TYR  10  -7.800  -3.148  -0.193
   63    HD2  TYR  10           HD2      TYR  10  -9.857  -0.325  -2.623
   64    HE1  TYR  10           HE1      TYR  10  -9.799  -4.579  -0.152
   65    HE2  TYR  10           HE2      TYR  10 -11.863  -1.748  -2.587
   66    HH   TYR  10           HH       TYR  10 -12.440  -4.106  -2.232
   67    H    THR  11           H        THR  11  -6.817   1.873   0.041
   68    HA   THR  11           HA       THR  11  -4.354   2.543  -1.111
   69    HB   THR  11           HB       THR  11  -5.859   4.202   0.918
   70    HG1  THR  11           HG1      THR  11  -6.215   3.970  -1.902
   71   HG21  THR  11          HG21      THR  11  -3.454   4.646  -0.481
   72   HG22  THR  11          HG22      THR  11  -4.378   5.805   0.475
   73   HG23  THR  11          HG23      THR  11  -4.678   5.652  -1.256
   74    H    ARG  12           H        ARG  12  -5.279   2.064   2.271
   75    HA   ARG  12           HA       ARG  12  -2.747   2.823   3.335
   76    HB2  ARG  12           HB2      ARG  12  -4.757   2.936   4.702
   77    HB3  ARG  12           HB3      ARG  12  -4.994   1.201   4.541
   78    HG2  ARG  12           HG2      ARG  12  -2.655   1.023   5.631
   79    HG3  ARG  12           HG3      ARG  12  -2.955   2.686   6.139
   80    HD2  ARG  12           HD2      ARG  12  -4.994   0.545   6.619
   81    HD3  ARG  12           HD3      ARG  12  -3.627   0.747   7.714
   82    HE   ARG  12           HE       ARG  12  -5.913   2.478   7.450
   83   HH11  ARG  12          HH12      ARG  12  -2.604   2.216   8.499
   84   HH12  ARG  12          HH11      ARG  12  -2.717   3.536   9.615
   85   HH21  ARG  12          HH22      ARG  12  -6.074   4.218   8.916
   86   HH22  ARG  12          HH21      ARG  12  -4.691   4.674   9.852
   87    H    LEU  13           H        LEU  13  -4.272  -0.284   2.577
   88    HA   LEU  13           HA       LEU  13  -2.237  -1.940   3.575
   89    HB2  LEU  13           HB2      LEU  13  -4.437  -2.788   3.029
   90    HB3  LEU  13           HB3      LEU  13  -4.192  -2.400   1.328
   91    HG   LEU  13           HG       LEU  13  -2.172  -4.070   1.574
   92   HD11  LEU  13          HD11      LEU  13  -2.032  -5.011   3.583
   93   HD12  LEU  13          HD12      LEU  13  -3.509  -5.885   3.182
   94   HD13  LEU  13          HD13      LEU  13  -3.598  -4.368   4.076
   95   HD21  LEU  13          HD21      LEU  13  -3.597  -5.840   0.769
   96   HD22  LEU  13          HD22      LEU  13  -4.142  -4.304   0.096
   97   HD23  LEU  13          HD23      LEU  13  -5.023  -5.044   1.434
   98    H    ARG  14           H        ARG  14  -2.674  -0.388   0.442
   99    HA   ARG  14           HA       ARG  14  -0.649  -1.698  -0.971
  100    HB2  ARG  14           HB2      ARG  14  -2.479   0.073  -1.697
  101    HB3  ARG  14           HB3      ARG  14  -1.153   1.203  -1.458
  102    HG2  ARG  14           HG2      ARG  14   0.210  -0.213  -3.014
  103    HG3  ARG  14           HG3      ARG  14  -1.264  -1.118  -3.365
  104    HD2  ARG  14           HD2      ARG  14  -2.299   1.159  -3.920
  105    HD3  ARG  14           HD3      ARG  14  -0.642   1.761  -3.945
  106    HE   ARG  14           HE       ARG  14  -1.127  -0.561  -5.596
  107   HH11  ARG  14          HH12      ARG  14  -1.028   2.914  -5.422
  108   HH12  ARG  14          HH11      ARG  14  -0.807   3.124  -7.127
  109   HH21  ARG  14          HH22      ARG  14  -0.837  -0.299  -7.843
  110   HH22  ARG  14          HH21      ARG  14  -0.700   1.295  -8.504
  111    H    LYS  15           H        LYS  15  -0.537   1.060   1.212
  112    HA   LYS  15           HA       LYS  15   2.065   1.935   0.696
  113    HB2  LYS  15           HB2      LYS  15   0.304   3.069   2.123
  114    HB3  LYS  15           HB3      LYS  15   0.741   1.951   3.408
  115    HG2  LYS  15           HG2      LYS  15   2.030   3.749   3.962
  116    HG3  LYS  15           HG3      LYS  15   3.159   2.853   2.943
  117    HD2  LYS  15           HD2      LYS  15   1.362   4.833   1.642
  118    HD3  LYS  15           HD3      LYS  15   2.716   5.441   2.596
  119    HE2  LYS  15           HE2      LYS  15   4.071   3.669   1.215
  120    HE3  LYS  15           HE3      LYS  15   2.726   3.827   0.087
  121    HZ1  LYS  15           HZ1      LYS  15   3.707   5.636  -0.692
  122    HZ2  LYS  15           HZ2      LYS  15   4.908   5.575   0.498
  123    HZ3  LYS  15           HZ3      LYS  15   3.461   6.399   0.798
  124    H    GLN  16           H        GLN  16   0.877  -0.562   2.904
  125    HA   GLN  16           HA       GLN  16   3.325  -1.137   4.155
  126    HB2  GLN  16           HB2      GLN  16   0.834  -2.766   3.700
  127    HB3  GLN  16           HB3      GLN  16   2.223  -3.418   4.559
  128    HG2  GLN  16           HG2      GLN  16   1.104  -0.808   5.436
  129    HG3  GLN  16           HG3      GLN  16   0.231  -2.287   5.836
  130   HE21  GLN  16          HE21      GLN  16   3.391  -0.733   6.060
  131   HE22  GLN  16          HE22      GLN  16   3.868  -1.508   7.528
  132    H    MET  17           H        MET  17   1.772  -2.576   1.305
  133    HA   MET  17           HA       MET  17   3.839  -4.464   0.819
  134    HB2  MET  17           HB2      MET  17   1.824  -3.343  -1.136
  135    HB3  MET  17           HB3      MET  17   2.750  -4.825  -1.328
  136    HG2  MET  17           HG2      MET  17   0.921  -4.455   1.008
  137    HG3  MET  17           HG3      MET  17   0.301  -4.969  -0.559
  138    HE1  MET  17           HE1      MET  17  -0.556  -6.866  -0.423
  139    HE2  MET  17           HE2      MET  17   0.555  -8.021  -1.158
  140    HE3  MET  17           HE3      MET  17  -0.064  -8.307   0.469
  141    H    ALA  18           H        ALA  18   3.210  -1.184  -0.292
  142    HA   ALA  18           HA       ALA  18   5.291  -1.155  -2.247
  143    HB1  ALA  18           HB1      ALA  18   4.363   0.775  -2.844
  144    HB2  ALA  18           HB2      ALA  18   3.164   0.503  -1.579
  145    HB3  ALA  18           HB3      ALA  18   4.604   1.464  -1.238
  146    H    VAL  19           H        VAL  19   5.097  -0.468   1.167
  147    HA   VAL  19           HA       VAL  19   7.441   1.050   1.465
  148    HB   VAL  19           HB       VAL  19   5.762  -0.592   3.292
  149   HG11  VAL  19          HG11      VAL  19   7.874  -1.333   4.055
  150   HG12  VAL  19          HG12      VAL  19   8.577   0.278   3.900
  151   HG13  VAL  19          HG13      VAL  19   7.381  -0.046   5.155
  152   HG21  VAL  19          HG21      VAL  19   6.426   1.823   4.469
  153   HG22  VAL  19          HG22      VAL  19   6.329   2.201   2.749
  154   HG23  VAL  19          HG23      VAL  19   4.951   1.467   3.570
  155    H    LYS  20           H        LYS  20   6.893  -2.448   1.547
  156    HA   LYS  20           HA       LYS  20   9.532  -3.171   2.250
  157    HB2  LYS  20           HB2      LYS  20   7.202  -4.604   1.036
  158    HB3  LYS  20           HB3      LYS  20   8.777  -5.386   1.053
  159    HG2  LYS  20           HG2      LYS  20   8.778  -5.656   3.313
  160    HG3  LYS  20           HG3      LYS  20   7.781  -4.227   3.596
  161    HD2  LYS  20           HD2      LYS  20   6.720  -6.732   2.305
  162    HD3  LYS  20           HD3      LYS  20   6.684  -6.464   4.049
  163    HE2  LYS  20           HE2      LYS  20   5.336  -4.476   3.747
  164    HE3  LYS  20           HE3      LYS  20   5.448  -4.633   1.995
  165    HZ1  LYS  20           HZ1      LYS  20   4.072  -6.481   3.866
  166    HZ2  LYS  20           HZ2      LYS  20   4.299  -6.798   2.220
  167    HZ3  LYS  20           HZ3      LYS  20   3.352  -5.483   2.704
  168    H    LYS  21           H        LYS  21   7.903  -2.835  -0.879
  169    HA   LYS  21           HA       LYS  21  10.023  -3.734  -2.487
  170    HB2  LYS  21           HB2      LYS  21   7.538  -3.213  -3.079
  171    HB3  LYS  21           HB3      LYS  21   8.131  -1.588  -3.394
  172    HG2  LYS  21           HG2      LYS  21   9.277  -4.049  -4.687
  173    HG3  LYS  21           HG3      LYS  21   7.981  -3.082  -5.394
  174    HD2  LYS  21           HD2      LYS  21   9.628  -1.099  -5.024
  175    HD3  LYS  21           HD3      LYS  21  10.851  -2.369  -4.939
  176    HE2  LYS  21           HE2      LYS  21  10.794  -1.670  -7.193
  177    HE3  LYS  21           HE3      LYS  21   9.942  -3.212  -7.142
  178    HZ1  LYS  21           HZ1      LYS  21   8.709  -0.514  -7.248
  179    HZ2  LYS  21           HZ2      LYS  21   7.842  -1.954  -7.062
  180    HZ3  LYS  21           HZ3      LYS  21   8.716  -1.671  -8.482
  181    H    TYR  22           H        TYR  22   9.154  -0.477  -1.383
  182    HA   TYR  22           HA       TYR  22  11.188   0.890  -2.771
  183    HB2  TYR  22           HB2      TYR  22   9.540   1.549  -0.343
  184    HB3  TYR  22           HB3      TYR  22  10.802   2.638  -0.907
  185    HD1  TYR  22           HD2      TYR  22  10.641   2.913  -3.651
  186    HD2  TYR  22           HD1      TYR  22   7.418   2.163  -0.976
  187    HE1  TYR  22           HE2      TYR  22   9.074   3.895  -5.272
  188    HE2  TYR  22           HE1      TYR  22   5.842   3.142  -2.591
  189    HH   TYR  22           HH       TYR  22   6.130   3.433  -5.496
  190    H    LEU  23           H        LEU  23  11.026  -0.175   0.625
  191    HA   LEU  23           HA       LEU  23  13.647   0.618   1.293
  192    HB2  LEU  23           HB2      LEU  23  13.254  -0.304   3.339
  193    HB3  LEU  23           HB3      LEU  23  11.600  -0.103   2.765
  194    HG   LEU  23           HG       LEU  23  11.793  -2.553   1.995
  195   HD11  LEU  23          HD11      LEU  23  13.585  -3.764   2.526
  196   HD12  LEU  23          HD12      LEU  23  13.635  -3.122   4.167
  197   HD13  LEU  23          HD13      LEU  23  14.395  -2.232   2.849
  198   HD21  LEU  23          HD21      LEU  23  11.880  -2.421   4.955
  199   HD22  LEU  23          HD22      LEU  23  10.696  -3.173   3.886
  200   HD23  LEU  23          HD23      LEU  23  10.678  -1.426   4.133
  201    H    ASN  24           H        ASN  24  12.338  -2.302  -0.125
  202    HA   ASN  24           HA       ASN  24  14.636  -3.926   0.229
  203    HB2  ASN  24           HB2      ASN  24  12.641  -5.092  -0.217
  204    HB3  ASN  24           HB3      ASN  24  12.247  -4.069  -1.596
  205   HD21  ASN  24          HD21      ASN  24  13.482  -4.316  -3.528
  206   HD22  ASN  24          HD22      ASN  24  14.243  -5.824  -3.887
  207    H    SER  25           H        SER  25  13.496  -1.892  -2.439
  208    HA   SER  25           HA       SER  25  15.635  -2.536  -4.196
  209    HB2  SER  25           HB2      SER  25  13.446  -0.520  -4.136
  210    HB3  SER  25           HB3      SER  25  14.827  -0.182  -5.179
  211    HG   SER  25           HG       SER  25  13.046  -2.374  -5.262
  212    H    ILE  26           H        ILE  26  14.995   0.285  -2.123
  213    HA   ILE  26           HA       ILE  26  17.213   1.809  -2.692
  214    HB   ILE  26           HB       ILE  26  15.903   1.432   0.003
  215   HG12  ILE  26          HG12      ILE  26  15.483   3.790  -1.790
  216   HG13  ILE  26          HG13      ILE  26  14.626   2.293  -2.140
  217   HG21  ILE  26          HG21      ILE  26  17.261   2.967   0.884
  218   HG22  ILE  26          HG22      ILE  26  18.302   2.680  -0.509
  219   HG23  ILE  26          HG23      ILE  26  17.141   4.008  -0.535
  220   HD11  ILE  26          HD11      ILE  26  13.096   3.344  -0.827
  221   HD12  ILE  26          HD12      ILE  26  13.994   2.460   0.407
  222   HD13  ILE  26          HD13      ILE  26  14.321   4.172   0.134
  223    H    LEU  27           H        LEU  27  16.951  -0.677  -0.150
  224    HA   LEU  27           HA       LEU  27  19.678  -0.519   0.612
  225    HB2  LEU  27           HB2      LEU  27  17.517  -2.553   1.057
  226    HB3  LEU  27           HB3      LEU  27  19.161  -2.809   1.637
  227    HG   LEU  27           HG       LEU  27  17.380  -0.508   2.439
  228   HD11  LEU  27          HD11      LEU  27  16.422  -2.435   3.389
  229   HD12  LEU  27          HD12      LEU  27  17.424  -1.733   4.659
  230   HD13  LEU  27          HD13      LEU  27  17.998  -3.136   3.758
  231   HD21  LEU  27          HD21      LEU  27  19.319  -0.738   4.328
  232   HD22  LEU  27          HD22      LEU  27  19.367   0.390   2.972
  233   HD23  LEU  27          HD23      LEU  27  20.210  -1.156   2.864
  234    H    ASN  28           H        ASN  28  17.890  -2.634  -1.586
  235    HA   ASN  28           HA       ASN  28  19.596  -4.617  -2.191
  236    HB2  ASN  28           HB2      ASN  28  17.476  -4.296  -3.368
  237    HB3  ASN  28           HB3      ASN  28  18.142  -2.907  -4.222
  238   HD21  ASN  28          HD21      ASN  28  19.029  -3.250  -6.131
  239   HD22  ASN  28          HD22      ASN  28  19.502  -4.787  -6.764
  240    H    GLY  29           H        GLY  29  19.944  -1.261  -3.257
  241    HA2  GLY  29           HA2      GLY  29  22.153  -1.632  -4.957
  242    HA3  GLY  29           HA3      GLY  29  21.724  -0.127  -4.157
  Start of MODEL    2
    1    H1   HIS   1           H        HIS   1 -22.866   6.618  -4.387
    2    HA   HIS   1           HA       HIS   1 -22.142   4.828  -2.172
    3    HB2  HIS   1           HB2      HIS   1 -21.929   4.523  -5.166
    4    HB3  HIS   1           HB3      HIS   1 -21.136   3.423  -4.042
    5    HD1  HIS   1           HD1      HIS   1 -23.671   2.982  -6.111
    6    HD2  HIS   1           HD2      HIS   1 -23.672   3.045  -1.956
    7    HE1  HIS   1           HE1      HIS   1 -25.714   1.689  -5.419
    8    HE2  HIS   1           HE2      HIS   1 -25.739   1.813  -2.904
    9    H    SER   2           H        SER   2 -20.650   6.163  -1.136
   10    HA   SER   2           HA       SER   2 -18.434   7.295  -2.598
   11    HB2  SER   2           HB2      SER   2 -19.543   8.309  -0.523
   12    HB3  SER   2           HB3      SER   2 -18.661   7.095   0.404
   13    HG   SER   2           HG       SER   2 -17.775   9.423  -0.456
   14    H    ASP   3           H        ASP   3 -18.936   4.652  -0.297
   15    HA   ASP   3           HA       ASP   3 -17.585   2.941   0.386
   16    HB2  ASP   3           HB2      ASP   3 -16.156   2.064  -1.684
   17    HB3  ASP   3           HB3      ASP   3 -17.899   1.827  -1.591
   18    H    ALA   4           H        ALA   4 -16.526   5.431   1.040
   19    HA   ALA   4           HA       ALA   4 -13.854   5.823   0.263
   20    HB1  ALA   4           HB1      ALA   4 -15.680   7.089   1.956
   21    HB2  ALA   4           HB2      ALA   4 -14.302   6.671   2.975
   22    HB3  ALA   4           HB3      ALA   4 -14.061   7.640   1.522
   23    H    VAL   5           H        VAL   5 -15.287   3.946   2.892
   24    HA   VAL   5           HA       VAL   5 -12.892   3.276   4.213
   25    HB   VAL   5           HB       VAL   5 -15.038   2.961   5.299
   26   HG11  VAL   5          HG11      VAL   5 -15.519   0.902   3.152
   27   HG12  VAL   5          HG12      VAL   5 -16.496   1.052   4.613
   28   HG13  VAL   5          HG13      VAL   5 -16.438   2.377   3.450
   29   HG21  VAL   5          HG21      VAL   5 -13.077   0.810   5.022
   30   HG22  VAL   5          HG22      VAL   5 -13.760   1.542   6.474
   31   HG23  VAL   5          HG23      VAL   5 -14.645   0.274   5.626
   32    H    PHE   6           H        PHE   6 -14.655   1.722   1.576
   33    HA   PHE   6           HA       PHE   6 -13.163  -0.649   1.450
   34    HB2  PHE   6           HB2      PHE   6 -14.788   0.874  -0.571
   35    HB3  PHE   6           HB3      PHE   6 -13.914  -0.585  -1.028
   36    HD1  PHE   6           HD1      PHE   6 -16.444   0.703   1.362
   37    HD2  PHE   6           HD2      PHE   6 -14.848  -2.682  -0.666
   38    HE1  PHE   6           HE1      PHE   6 -18.314  -0.668   2.186
   39    HE2  PHE   6           HE2      PHE   6 -16.716  -4.058   0.154
   40    HZ   PHE   6           HZ       PHE   6 -18.452  -3.051   1.581
   41    H    THR   7           H        THR   7 -12.823   2.330  -0.477
   42    HA   THR   7           HA       THR   7 -10.453   1.501  -1.786
   43    HB   THR   7           HB       THR   7 -11.897   3.261  -2.707
   44    HG1  THR   7           HG1      THR   7  -9.172   3.667  -2.219
   45   HG21  THR   7          HG21      THR   7 -12.504   4.349  -0.584
   46   HG22  THR   7          HG22      THR   7 -11.887   5.508  -1.762
   47   HG23  THR   7          HG23      THR   7 -10.858   4.962  -0.438
   48    H    ASP   8           H        ASP   8 -11.071   3.390   1.128
   49    HA   ASP   8           HA       ASP   8  -8.498   4.342   1.608
   50    HB2  ASP   8           HB2      ASP   8 -10.015   5.287   3.050
   51    HB3  ASP   8           HB3      ASP   8 -10.880   3.774   3.302
   52    H    ASN   9           H        ASN   9  -9.986   1.260   2.521
   53    HA   ASN   9           HA       ASN   9  -7.873   0.265   4.069
   54    HB2  ASN   9           HB2      ASN   9 -10.181  -0.939   2.616
   55    HB3  ASN   9           HB3      ASN   9  -8.896  -2.017   3.155
   56   HD21  ASN   9          HD21      ASN   9  -8.209  -1.600   5.489
   57   HD22  ASN   9          HD22      ASN   9  -9.495  -1.397   6.625
   58    H    TYR  10           H        TYR  10  -8.522   0.033   0.599
   59    HA   TYR  10           HA       TYR  10  -6.320  -1.664   0.018
   60    HB2  TYR  10           HB2      TYR  10  -7.714   0.239  -1.872
   61    HB3  TYR  10           HB3      TYR  10  -6.784  -1.193  -2.302
   62    HD1  TYR  10           HD1      TYR  10  -7.832  -3.167  -0.373
   63    HD2  TYR  10           HD2      TYR  10  -9.865  -0.207  -2.655
   64    HE1  TYR  10           HE1      TYR  10  -9.882  -4.524  -0.297
   65    HE2  TYR  10           HE2      TYR  10 -11.920  -1.555  -2.584
   66    HH   TYR  10           HH       TYR  10 -12.912  -3.326  -1.129
   67    H    THR  11           H        THR  11  -6.789   1.838  -0.052
   68    HA   THR  11           HA       THR  11  -4.351   2.548  -1.233
   69    HB   THR  11           HB       THR  11  -5.966   4.100   0.800
   70    HG1  THR  11           HG1      THR  11  -5.938   4.359  -2.034
   71   HG21  THR  11          HG21      THR  11  -3.427   4.646  -0.423
   72   HG22  THR  11          HG22      THR  11  -4.332   5.614   0.741
   73   HG23  THR  11          HG23      THR  11  -4.624   5.811  -0.987
   74    H    ARG  12           H        ARG  12  -5.221   2.126   2.184
   75    HA   ARG  12           HA       ARG  12  -2.656   2.823   3.187
   76    HB2  ARG  12           HB2      ARG  12  -4.833   2.845   4.476
   77    HB3  ARG  12           HB3      ARG  12  -4.714   1.093   4.557
   78    HG2  ARG  12           HG2      ARG  12  -2.484   1.395   5.668
   79    HG3  ARG  12           HG3      ARG  12  -2.850   3.118   5.762
   80    HD2  ARG  12           HD2      ARG  12  -4.588   2.797   7.263
   81    HD3  ARG  12           HD3      ARG  12  -4.800   1.107   6.806
   82    HE   ARG  12           HE       ARG  12  -2.937   2.171   8.740
   83   HH11  ARG  12          HH12      ARG  12  -3.779  -0.516   6.693
   84   HH12  ARG  12          HH11      ARG  12  -2.893  -1.675   7.628
   85   HH21  ARG  12          HH22      ARG  12  -1.766   0.655   9.979
   86   HH22  ARG  12          HH21      ARG  12  -1.749  -1.008   9.497
   87    H    LEU  13           H        LEU  13  -4.241  -0.268   2.484
   88    HA   LEU  13           HA       LEU  13  -2.215  -1.951   3.445
   89    HB2  LEU  13           HB2      LEU  13  -4.381  -2.834   2.963
   90    HB3  LEU  13           HB3      LEU  13  -4.266  -2.339   1.275
   91    HG   LEU  13           HG       LEU  13  -2.235  -3.997   1.246
   92   HD11  LEU  13          HD11      LEU  13  -2.826  -5.975   2.729
   93   HD12  LEU  13          HD12      LEU  13  -3.803  -4.842   3.664
   94   HD13  LEU  13          HD13      LEU  13  -2.064  -4.589   3.511
   95   HD21  LEU  13          HD21      LEU  13  -4.473  -5.739   1.259
   96   HD22  LEU  13          HD22      LEU  13  -3.648  -5.019  -0.124
   97   HD23  LEU  13          HD23      LEU  13  -5.003  -4.178   0.631
   98    H    ARG  14           H        ARG  14  -2.689  -0.434   0.293
   99    HA   ARG  14           HA       ARG  14  -0.660  -1.765  -1.105
  100    HB2  ARG  14           HB2      ARG  14  -2.525  -0.068  -1.883
  101    HB3  ARG  14           HB3      ARG  14  -1.239   1.111  -1.667
  102    HG2  ARG  14           HG2      ARG  14  -0.641  -1.327  -3.250
  103    HG3  ARG  14           HG3      ARG  14  -1.661  -0.084  -3.978
  104    HD2  ARG  14           HD2      ARG  14   0.047   1.575  -3.672
  105    HD3  ARG  14           HD3      ARG  14   1.039   0.447  -2.750
  106    HE   ARG  14           HE       ARG  14   0.771  -0.811  -5.113
  107   HH11  ARG  14          HH12      ARG  14   1.697   2.437  -4.266
  108   HH12  ARG  14          HH11      ARG  14   2.733   2.639  -5.640
  109   HH21  ARG  14          HH22      ARG  14   2.132  -0.556  -6.926
  110   HH22  ARG  14          HH21      ARG  14   2.979   0.937  -7.153
  111    H    LYS  15           H        LYS  15  -0.577   1.055   0.995
  112    HA   LYS  15           HA       LYS  15   2.019   1.939   0.421
  113    HB2  LYS  15           HB2      LYS  15   0.650   3.398   1.670
  114    HB3  LYS  15           HB3      LYS  15   0.272   2.161   2.862
  115    HG2  LYS  15           HG2      LYS  15   1.795   3.848   3.751
  116    HG3  LYS  15           HG3      LYS  15   2.542   2.249   3.712
  117    HD2  LYS  15           HD2      LYS  15   4.145   3.864   2.942
  118    HD3  LYS  15           HD3      LYS  15   3.637   2.879   1.568
  119    HE2  LYS  15           HE2      LYS  15   2.512   4.603   0.574
  120    HE3  LYS  15           HE3      LYS  15   2.148   5.393   2.107
  121    HZ1  LYS  15           HZ1      LYS  15   4.949   5.271   1.290
  122    HZ2  LYS  15           HZ2      LYS  15   4.117   6.487   2.120
  123    HZ3  LYS  15           HZ3      LYS  15   3.942   6.336   0.444
  124    H    GLN  16           H        GLN  16   0.840  -0.483   2.708
  125    HA   GLN  16           HA       GLN  16   3.304  -0.964   3.995
  126    HB2  GLN  16           HB2      GLN  16   0.710  -2.412   3.761
  127    HB3  GLN  16           HB3      GLN  16   2.102  -3.308   4.352
  128    HG2  GLN  16           HG2      GLN  16   1.346  -0.674   5.552
  129    HG3  GLN  16           HG3      GLN  16   0.548  -2.166   6.047
  130   HE21  GLN  16          HE21      GLN  16   3.639  -0.519   5.838
  131   HE22  GLN  16          HE22      GLN  16   4.416  -1.418   7.092
  132    H    MET  17           H        MET  17   1.714  -2.567   1.254
  133    HA   MET  17           HA       MET  17   3.770  -4.486   0.858
  134    HB2  MET  17           HB2      MET  17   1.721  -3.476  -1.122
  135    HB3  MET  17           HB3      MET  17   2.658  -4.958  -1.263
  136    HG2  MET  17           HG2      MET  17   0.922  -4.535   1.123
  137    HG3  MET  17           HG3      MET  17   0.202  -5.023  -0.410
  138    HE1  MET  17           HE1      MET  17  -0.821  -6.750   0.526
  139    HE2  MET  17           HE2      MET  17  -0.167  -8.282  -0.054
  140    HE3  MET  17           HE3      MET  17  -0.161  -7.918   1.672
  141    H    ALA  18           H        ALA  18   3.138  -1.275  -0.435
  142    HA   ALA  18           HA       ALA  18   5.192  -1.369  -2.416
  143    HB1  ALA  18           HB1      ALA  18   4.463   0.675  -3.043
  144    HB2  ALA  18           HB2      ALA  18   3.070   0.234  -2.054
  145    HB3  ALA  18           HB3      ALA  18   4.338   1.260  -1.384
  146    H    VAL  19           H        VAL  19   5.048  -0.488   0.955
  147    HA   VAL  19           HA       VAL  19   7.400   1.037   1.135
  148    HB   VAL  19           HB       VAL  19   5.743  -0.496   3.074
  149   HG11  VAL  19          HG11      VAL  19   7.393   0.157   4.880
  150   HG12  VAL  19          HG12      VAL  19   7.862  -1.199   3.852
  151   HG13  VAL  19          HG13      VAL  19   8.569   0.396   3.589
  152   HG21  VAL  19          HG21      VAL  19   6.615   2.081   3.943
  153   HG22  VAL  19          HG22      VAL  19   6.071   2.190   2.269
  154   HG23  VAL  19          HG23      VAL  19   4.991   1.548   3.507
  155    H    LYS  20           H        LYS  20   6.844  -2.448   1.390
  156    HA   LYS  20           HA       LYS  20   9.484  -3.148   2.114
  157    HB2  LYS  20           HB2      LYS  20   7.140  -4.624   0.985
  158    HB3  LYS  20           HB3      LYS  20   8.712  -5.411   1.012
  159    HG2  LYS  20           HG2      LYS  20   8.742  -5.589   3.281
  160    HG3  LYS  20           HG3      LYS  20   7.755  -4.146   3.519
  161    HD2  LYS  20           HD2      LYS  20   6.665  -6.693   2.342
  162    HD3  LYS  20           HD3      LYS  20   6.657  -6.360   4.076
  163    HE2  LYS  20           HE2      LYS  20   5.293  -4.406   3.742
  164    HE3  LYS  20           HE3      LYS  20   5.415  -4.569   1.991
  165    HZ1  LYS  20           HZ1      LYS  20   3.316  -5.418   2.682
  166    HZ2  LYS  20           HZ2      LYS  20   4.021  -6.402   3.863
  167    HZ3  LYS  20           HZ3      LYS  20   4.268  -6.739   2.224
  168    H    LYS  21           H        LYS  21   7.850  -2.891  -1.014
  169    HA   LYS  21           HA       LYS  21   9.965  -3.883  -2.590
  170    HB2  LYS  21           HB2      LYS  21   7.595  -3.597  -3.342
  171    HB3  LYS  21           HB3      LYS  21   7.871  -1.861  -3.405
  172    HG2  LYS  21           HG2      LYS  21   8.116  -2.608  -5.609
  173    HG3  LYS  21           HG3      LYS  21   9.762  -2.368  -5.019
  174    HD2  LYS  21           HD2      LYS  21  10.059  -4.716  -4.684
  175    HD3  LYS  21           HD3      LYS  21   8.352  -5.032  -5.000
  176    HE2  LYS  21           HE2      LYS  21   8.844  -3.942  -7.304
  177    HE3  LYS  21           HE3      LYS  21  10.529  -4.286  -6.914
  178    HZ1  LYS  21           HZ1      LYS  21   9.080  -6.592  -6.370
  179    HZ2  LYS  21           HZ2      LYS  21  10.196  -6.344  -7.616
  180    HZ3  LYS  21           HZ3      LYS  21   8.552  -6.045  -7.882
  181    H    TYR  22           H        TYR  22   9.098  -0.592  -1.601
  182    HA   TYR  22           HA       TYR  22  11.147   0.703  -3.063
  183    HB2  TYR  22           HB2      TYR  22   9.364   1.486  -0.786
  184    HB3  TYR  22           HB3      TYR  22  10.705   2.533  -1.238
  185    HD1  TYR  22           HD1      TYR  22   8.211   0.549  -3.200
  186    HD2  TYR  22           HD2      TYR  22   9.948   4.355  -2.427
  187    HE1  TYR  22           HE1      TYR  22   6.832   1.533  -4.983
  188    HE2  TYR  22           HE2      TYR  22   8.573   5.350  -4.207
  189    HH   TYR  22           HH       TYR  22   7.169   3.754  -6.554
  190    H    LEU  23           H        LEU  23  10.897  -0.132   0.393
  191    HA   LEU  23           HA       LEU  23  13.487   0.718   1.088
  192    HB2  LEU  23           HB2      LEU  23  13.139  -0.333   3.158
  193    HB3  LEU  23           HB3      LEU  23  11.552   0.224   2.633
  194    HG   LEU  23           HG       LEU  23  11.289  -2.215   1.753
  195   HD11  LEU  23          HD11      LEU  23  12.903  -3.104   4.015
  196   HD12  LEU  23          HD12      LEU  23  13.851  -2.433   2.689
  197   HD13  LEU  23          HD13      LEU  23  12.750  -3.778   2.392
  198   HD21  LEU  23          HD21      LEU  23  10.529  -2.904   4.063
  199   HD22  LEU  23          HD22      LEU  23   9.854  -1.397   3.442
  200   HD23  LEU  23          HD23      LEU  23  11.155  -1.357   4.633
  201    H    ASN  24           H        ASN  24  12.270  -2.271  -0.250
  202    HA   ASN  24           HA       ASN  24  14.513  -3.896   0.288
  203    HB2  ASN  24           HB2      ASN  24  12.634  -5.113  -0.334
  204    HB3  ASN  24           HB3      ASN  24  12.239  -4.021  -1.658
  205   HD21  ASN  24          HD21      ASN  24  13.608  -4.083  -3.550
  206   HD22  ASN  24          HD22      ASN  24  14.377  -5.566  -3.991
  207    H    SER  25           H        SER  25  13.618  -1.977  -2.567
  208    HA   SER  25           HA       SER  25  15.960  -2.629  -4.040
  209    HB2  SER  25           HB2      SER  25  13.942  -1.872  -5.178
  210    HB3  SER  25           HB3      SER  25  14.025  -0.319  -4.346
  211    HG   SER  25           HG       SER  25  15.231   0.296  -5.940
  212    H    ILE  26           H        ILE  26  15.019   0.183  -2.090
  213    HA   ILE  26           HA       ILE  26  17.220   1.803  -2.526
  214    HB   ILE  26           HB       ILE  26  15.614   1.463   0.008
  215   HG12  ILE  26          HG12      ILE  26  15.437   3.722  -1.970
  216   HG13  ILE  26          HG13      ILE  26  14.531   2.233  -2.214
  217   HG21  ILE  26          HG21      ILE  26  18.046   2.819  -0.333
  218   HG22  ILE  26          HG22      ILE  26  16.792   4.057  -0.296
  219   HG23  ILE  26          HG23      ILE  26  16.941   2.914   1.037
  220   HD11  ILE  26          HD11      ILE  26  12.936   3.248  -1.039
  221   HD12  ILE  26          HD12      ILE  26  13.923   2.859   0.371
  222   HD13  ILE  26          HD13      ILE  26  14.050   4.448  -0.384
  223    H    LEU  27           H        LEU  27  16.792  -0.641   0.029
  224    HA   LEU  27           HA       LEU  27  19.398  -0.333   1.100
  225    HB2  LEU  27           HB2      LEU  27  17.511  -2.677   1.277
  226    HB3  LEU  27           HB3      LEU  27  18.939  -2.432   2.281
  227    HG   LEU  27           HG       LEU  27  16.755  -0.389   2.277
  228   HD11  LEU  27          HD11      LEU  27  15.843  -2.758   2.634
  229   HD12  LEU  27          HD12      LEU  27  15.469  -1.535   3.847
  230   HD13  LEU  27          HD13      LEU  27  16.733  -2.724   4.156
  231   HD21  LEU  27          HD21      LEU  27  17.573   0.083   4.472
  232   HD22  LEU  27          HD22      LEU  27  18.958   0.001   3.383
  233   HD23  LEU  27          HD23      LEU  27  18.599  -1.352   4.457
  234    H    ASN  28           H        ASN  28  17.992  -2.582  -1.243
  235    HA   ASN  28           HA       ASN  28  19.884  -4.456  -1.613
  236    HB2  ASN  28           HB2      ASN  28  17.863  -4.283  -3.000
  237    HB3  ASN  28           HB3      ASN  28  18.556  -2.901  -3.844
  238   HD21  ASN  28          HD21      ASN  28  18.690  -3.741  -5.849
  239   HD22  ASN  28          HD22      ASN  28  19.668  -5.101  -6.270
  240    H    GLY  29           H        GLY  29  20.100  -1.108  -2.741
  241    HA2  GLY  29           HA2      GLY  29  22.929  -1.614  -3.431
  242    HA3  GLY  29           HA3      GLY  29  21.926  -0.411  -4.228
  Start of MODEL    3
    1    H1   HIS   1           H        HIS   1 -18.981   7.336  -6.857
    2    HA   HIS   1           HA       HIS   1 -16.822   6.162  -5.411
    3    HB2  HIS   1           HB2      HIS   1 -16.962   8.301  -4.060
    4    HB3  HIS   1           HB3      HIS   1 -16.713   8.510  -5.791
    5    HD1  HIS   1           HD1      HIS   1 -18.850   9.282  -7.181
    6    HD2  HIS   1           HD2      HIS   1 -19.209   9.504  -3.047
    7    HE1  HIS   1           HE1      HIS   1 -20.838  10.763  -6.757
    8    HE2  HIS   1           HE2      HIS   1 -20.984  10.951  -4.250
    9    H    SER   2           H        SER   2 -19.058   4.551  -5.089
   10    HA   SER   2           HA       SER   2 -20.297   5.105  -2.546
   11    HB2  SER   2           HB2      SER   2 -21.252   3.776  -4.600
   12    HB3  SER   2           HB3      SER   2 -20.404   2.415  -3.865
   13    HG   SER   2           HG       SER   2 -21.609   3.350  -1.867
   14    H    ASP   3           H        ASP   3 -17.959   2.735  -3.786
   15    HA   ASP   3           HA       ASP   3 -17.471   1.663  -1.150
   16    HB2  ASP   3           HB2      ASP   3 -15.515   0.546  -2.563
   17    HB3  ASP   3           HB3      ASP   3 -17.177  -0.025  -2.673
   18    H    ALA   4           H        ALA   4 -17.005   4.334  -1.032
   19    HA   ALA   4           HA       ALA   4 -14.319   5.088  -1.542
   20    HB1  ALA   4           HB1      ALA   4 -16.658   6.351  -0.635
   21    HB2  ALA   4           HB2      ALA   4 -15.443   6.594   0.620
   22    HB3  ALA   4           HB3      ALA   4 -15.111   7.098  -1.037
   23    H    VAL   5           H        VAL   5 -15.996   4.019   1.405
   24    HA   VAL   5           HA       VAL   5 -13.764   4.198   3.118
   25    HB   VAL   5           HB       VAL   5 -15.800   4.062   4.237
   26   HG11  VAL   5          HG11      VAL   5 -17.330   3.310   2.660
   27   HG12  VAL   5          HG12      VAL   5 -16.426   1.828   2.343
   28   HG13  VAL   5          HG13      VAL   5 -17.323   2.011   3.851
   29   HG21  VAL   5          HG21      VAL   5 -14.642   1.279   4.379
   30   HG22  VAL   5          HG22      VAL   5 -14.098   2.676   5.308
   31   HG23  VAL   5          HG23      VAL   5 -15.711   2.014   5.574
   32    H    PHE   6           H        PHE   6 -15.002   1.593   1.089
   33    HA   PHE   6           HA       PHE   6 -13.276  -0.429   2.057
   34    HB2  PHE   6           HB2      PHE   6 -14.845  -0.105  -0.494
   35    HB3  PHE   6           HB3      PHE   6 -13.820  -1.508  -0.210
   36    HD1  PHE   6           HD2      PHE   6 -14.379  -3.126   1.527
   37    HD2  PHE   6           HD1      PHE   6 -16.912   0.188   0.680
   38    HE1  PHE   6           HE2      PHE   6 -16.208  -4.212   2.764
   39    HE2  PHE   6           HE1      PHE   6 -18.745  -0.892   1.916
   40    HZ   PHE   6           HZ       PHE   6 -18.394  -3.095   2.960
   41    H    THR   7           H        THR   7 -13.124   1.538  -0.912
   42    HA   THR   7           HA       THR   7 -10.582   0.600  -1.713
   43    HB   THR   7           HB       THR   7 -12.160   1.683  -3.272
   44    HG1  THR   7           HG1      THR   7  -9.791   1.675  -3.589
   45   HG21  THR   7          HG21      THR   7 -12.608   3.544  -1.433
   46   HG22  THR   7          HG22      THR   7 -12.807   3.876  -3.154
   47   HG23  THR   7          HG23      THR   7 -11.336   4.379  -2.323
   48    H    ASP   8           H        ASP   8 -11.620   3.363   0.218
   49    HA   ASP   8           HA       ASP   8  -9.216   4.759   0.357
   50    HB2  ASP   8           HB2      ASP   8 -11.024   5.912   1.252
   51    HB3  ASP   8           HB3      ASP   8 -11.583   4.522   2.178
   52    H    ASN   9           H        ASN   9 -10.378   2.038   2.290
   53    HA   ASN   9           HA       ASN   9  -8.154   2.028   4.074
   54    HB2  ASN   9           HB2      ASN   9 -10.457   1.017   4.492
   55    HB3  ASN   9           HB3      ASN   9  -9.946  -0.323   3.470
   56   HD21  ASN   9          HD21      ASN   9 -10.598  -1.158   5.788
   57   HD22  ASN   9          HD22      ASN   9  -9.251  -1.445   6.831
   58    H    TYR  10           H        TYR  10  -8.794   0.658   0.950
   59    HA   TYR  10           HA       TYR  10  -6.901  -1.407   0.918
   60    HB2  TYR  10           HB2      TYR  10  -7.879   0.327  -1.360
   61    HB3  TYR  10           HB3      TYR  10  -6.985  -1.177  -1.550
   62    HD1  TYR  10           HD1      TYR  10  -8.868  -1.854   1.194
   63    HD2  TYR  10           HD2      TYR  10  -9.384  -1.150  -2.970
   64    HE1  TYR  10           HE1      TYR  10 -10.980  -3.114   1.249
   65    HE2  TYR  10           HE2      TYR  10 -11.497  -2.408  -2.927
   66    HH   TYR  10           HH       TYR  10 -12.799  -3.710   0.102
   67    H    THR  11           H        THR  11  -6.594   2.043   0.300
   68    HA   THR  11           HA       THR  11  -4.033   2.090  -0.803
   69    HB   THR  11           HB       THR  11  -5.762   4.022  -0.420
   70    HG1  THR  11           HG1      THR  11  -4.175   5.310  -1.115
   71   HG21  THR  11          HG21      THR  11  -3.927   4.497   1.925
   72   HG22  THR  11          HG22      THR  11  -5.549   3.822   2.088
   73   HG23  THR  11          HG23      THR  11  -5.331   5.447   1.437
   74    H    ARG  12           H        ARG  12  -5.068   2.054   2.576
   75    HA   ARG  12           HA       ARG  12  -2.576   2.504   3.767
   76    HB2  ARG  12           HB2      ARG  12  -4.727   0.727   4.912
   77    HB3  ARG  12           HB3      ARG  12  -3.539   1.684   5.787
   78    HG2  ARG  12           HG2      ARG  12  -5.867   2.721   4.185
   79    HG3  ARG  12           HG3      ARG  12  -5.688   2.741   5.940
   80    HD2  ARG  12           HD2      ARG  12  -3.950   4.212   3.962
   81    HD3  ARG  12           HD3      ARG  12  -5.205   4.931   4.969
   82    HE   ARG  12           HE       ARG  12  -3.118   3.531   6.403
   83   HH11  ARG  12          HH12      ARG  12  -4.253   6.568   5.135
   84   HH12  ARG  12          HH11      ARG  12  -3.284   7.526   6.206
   85   HH21  ARG  12          HH22      ARG  12  -1.838   4.781   7.818
   86   HH22  ARG  12          HH21      ARG  12  -1.911   6.508   7.731
   87    H    LEU  13           H        LEU  13  -4.128  -0.487   2.697
   88    HA   LEU  13           HA       LEU  13  -2.131  -2.230   3.713
   89    HB2  LEU  13           HB2      LEU  13  -4.346  -3.042   3.214
   90    HB3  LEU  13           HB3      LEU  13  -4.166  -2.594   1.519
   91    HG   LEU  13           HG       LEU  13  -2.174  -4.296   1.595
   92   HD11  LEU  13          HD11      LEU  13  -1.999  -4.954   3.790
   93   HD12  LEU  13          HD12      LEU  13  -3.023  -6.228   3.130
   94   HD13  LEU  13          HD13      LEU  13  -3.742  -4.911   4.057
   95   HD21  LEU  13          HD21      LEU  13  -3.703  -6.064   0.900
   96   HD22  LEU  13          HD22      LEU  13  -4.177  -4.511   0.211
   97   HD23  LEU  13          HD23      LEU  13  -5.061  -5.173   1.587
   98    H    ARG  14           H        ARG  14  -2.629  -0.643   0.599
   99    HA   ARG  14           HA       ARG  14  -0.634  -1.960  -0.857
  100    HB2  ARG  14           HB2      ARG  14  -2.487  -0.196  -1.547
  101    HB3  ARG  14           HB3      ARG  14  -1.157   0.937  -1.347
  102    HG2  ARG  14           HG2      ARG  14   0.156  -0.614  -2.900
  103    HG3  ARG  14           HG3      ARG  14  -1.411  -1.329  -3.289
  104    HD2  ARG  14           HD2      ARG  14  -2.161   1.092  -3.739
  105    HD3  ARG  14           HD3      ARG  14  -0.439   1.465  -3.779
  106    HE   ARG  14           HE       ARG  14  -0.381   0.581  -5.873
  107   HH11  ARG  14          HH12      ARG  14  -3.074  -0.821  -4.168
  108   HH12  ARG  14          HH11      ARG  14  -3.629  -1.735  -5.531
  109   HH21  ARG  14          HH22      ARG  14  -1.102  -0.618  -7.674
  110   HH22  ARG  14          HH21      ARG  14  -2.506  -1.620  -7.525
  111    H    LYS  15           H        LYS  15  -0.485   0.803   1.317
  112    HA   LYS  15           HA       LYS  15   2.101   1.688   0.739
  113    HB2  LYS  15           HB2      LYS  15   0.489   2.925   2.144
  114    HB3  LYS  15           HB3      LYS  15   0.681   1.719   3.409
  115    HG2  LYS  15           HG2      LYS  15   2.119   3.299   4.176
  116    HG3  LYS  15           HG3      LYS  15   3.227   2.377   3.157
  117    HD2  LYS  15           HD2      LYS  15   2.425   4.052   1.305
  118    HD3  LYS  15           HD3      LYS  15   1.996   5.057   2.692
  119    HE2  LYS  15           HE2      LYS  15   4.711   3.810   2.497
  120    HE3  LYS  15           HE3      LYS  15   4.347   5.297   1.622
  121    HZ1  LYS  15           HZ1      LYS  15   3.901   6.425   3.625
  122    HZ2  LYS  15           HZ2      LYS  15   5.340   5.577   3.893
  123    HZ3  LYS  15           HZ3      LYS  15   3.885   4.998   4.533
  124    H    GLN  16           H        GLN  16   0.966  -0.849   2.917
  125    HA   GLN  16           HA       GLN  16   3.447  -1.398   4.138
  126    HB2  GLN  16           HB2      GLN  16   0.879  -2.897   3.815
  127    HB3  GLN  16           HB3      GLN  16   2.292  -3.744   4.428
  128    HG2  GLN  16           HG2      GLN  16   1.119  -1.247   5.629
  129    HG3  GLN  16           HG3      GLN  16   0.835  -2.887   6.210
  130   HE21  GLN  16          HE21      GLN  16   3.067  -0.258   6.022
  131   HE22  GLN  16          HE22      GLN  16   4.244  -0.901   7.112
  132    H    MET  17           H        MET  17   1.830  -2.845   1.327
  133    HA   MET  17           HA       MET  17   3.890  -4.727   0.794
  134    HB2  MET  17           HB2      MET  17   1.776  -3.612  -1.058
  135    HB3  MET  17           HB3      MET  17   2.759  -5.036  -1.369
  136    HG2  MET  17           HG2      MET  17   1.121  -4.934   1.112
  137    HG3  MET  17           HG3      MET  17   0.326  -5.244  -0.430
  138    HE1  MET  17           HE1      MET  17   0.361  -8.036   1.855
  139    HE2  MET  17           HE2      MET  17   2.050  -8.000   2.361
  140    HE3  MET  17           HE3      MET  17   1.078  -6.529   2.427
  141    H    ALA  18           H        ALA  18   3.227  -1.450  -0.301
  142    HA   ALA  18           HA       ALA  18   5.257  -1.417  -2.309
  143    HB1  ALA  18           HB1      ALA  18   4.077   0.368  -2.894
  144    HB2  ALA  18           HB2      ALA  18   3.220   0.359  -1.352
  145    HB3  ALA  18           HB3      ALA  18   4.750   1.223  -1.506
  146    H    VAL  19           H        VAL  19   5.155  -0.750   1.110
  147    HA   VAL  19           HA       VAL  19   7.494   0.783   1.356
  148    HB   VAL  19           HB       VAL  19   5.880  -0.889   3.214
  149   HG11  VAL  19          HG11      VAL  19   8.706  -0.006   3.745
  150   HG12  VAL  19          HG12      VAL  19   7.549  -0.339   5.036
  151   HG13  VAL  19          HG13      VAL  19   8.014  -1.620   3.916
  152   HG21  VAL  19          HG21      VAL  19   5.830   1.719   2.552
  153   HG22  VAL  19          HG22      VAL  19   5.288   1.099   4.111
  154   HG23  VAL  19          HG23      VAL  19   6.907   1.777   3.947
  155    H    LYS  20           H        LYS  20   6.973  -2.713   1.352
  156    HA   LYS  20           HA       LYS  20   9.619  -3.446   2.017
  157    HB2  LYS  20           HB2      LYS  20   7.291  -4.849   0.761
  158    HB3  LYS  20           HB3      LYS  20   8.871  -5.622   0.748
  159    HG2  LYS  20           HG2      LYS  20   8.882  -5.961   3.000
  160    HG3  LYS  20           HG3      LYS  20   7.865  -4.556   3.329
  161    HD2  LYS  20           HD2      LYS  20   6.836  -7.027   1.951
  162    HD3  LYS  20           HD3      LYS  20   6.804  -6.829   3.704
  163    HE2  LYS  20           HE2      LYS  20   5.344  -4.975   3.562
  164    HE3  LYS  20           HE3      LYS  20   5.600  -4.813   1.825
  165    HZ1  LYS  20           HZ1      LYS  20   4.486  -7.329   2.817
  166    HZ2  LYS  20           HZ2      LYS  20   4.191  -6.518   1.362
  167    HZ3  LYS  20           HZ3      LYS  20   3.472  -5.975   2.794
  168    H    LYS  21           H        LYS  21   7.978  -2.974  -1.085
  169    HA   LYS  21           HA       LYS  21  10.125  -3.800  -2.720
  170    HB2  LYS  21           HB2      LYS  21   7.639  -3.402  -3.326
  171    HB3  LYS  21           HB3      LYS  21   8.115  -1.723  -3.549
  172    HG2  LYS  21           HG2      LYS  21   9.706  -3.822  -4.920
  173    HG3  LYS  21           HG3      LYS  21   8.100  -3.442  -5.546
  174    HD2  LYS  21           HD2      LYS  21   8.688  -1.285  -6.115
  175    HD3  LYS  21           HD3      LYS  21   9.997  -1.218  -4.932
  176    HE2  LYS  21           HE2      LYS  21  10.038  -2.945  -7.402
  177    HE3  LYS  21           HE3      LYS  21  10.744  -1.332  -7.317
  178    HZ1  LYS  21           HZ1      LYS  21  12.550  -2.589  -6.805
  179    HZ2  LYS  21           HZ2      LYS  21  11.649  -3.825  -6.082
  180    HZ3  LYS  21           HZ3      LYS  21  11.932  -2.384  -5.243
  181    H    TYR  22           H        TYR  22   9.252  -0.697  -1.311
  182    HA   TYR  22           HA       TYR  22  11.155   0.844  -2.750
  183    HB2  TYR  22           HB2      TYR  22   9.476   1.285  -0.312
  184    HB3  TYR  22           HB3      TYR  22  10.779   2.413  -0.670
  185    HD1  TYR  22           HD1      TYR  22   8.379   0.644  -2.919
  186    HD2  TYR  22           HD2      TYR  22   9.805   4.370  -1.438
  187    HE1  TYR  22           HE1      TYR  22   6.912   1.828  -4.499
  188    HE2  TYR  22           HE2      TYR  22   8.341   5.563  -3.013
  189    HH   TYR  22           HH       TYR  22   5.819   4.111  -4.639
  190    H    LEU  23           H        LEU  23  11.140  -0.383   0.598
  191    HA   LEU  23           HA       LEU  23  13.711   0.469   1.285
  192    HB2  LEU  23           HB2      LEU  23  13.604  -1.259   3.046
  193    HB3  LEU  23           HB3      LEU  23  12.167  -0.241   2.970
  194    HG   LEU  23           HG       LEU  23  11.177  -2.191   1.564
  195   HD11  LEU  23          HD11      LEU  23  12.748  -4.057   3.155
  196   HD12  LEU  23          HD12      LEU  23  13.694  -3.225   1.921
  197   HD13  LEU  23          HD13      LEU  23  12.257  -4.139   1.463
  198   HD21  LEU  23          HD21      LEU  23  11.019  -3.401   4.025
  199   HD22  LEU  23          HD22      LEU  23   9.981  -2.097   3.448
  200   HD23  LEU  23          HD23      LEU  23  11.398  -1.728   4.432
  201    H    ASN  24           H        ASN  24  12.606  -2.395  -0.410
  202    HA   ASN  24           HA       ASN  24  14.973  -3.903  -0.272
  203    HB2  ASN  24           HB2      ASN  24  12.905  -4.933  -0.983
  204    HB3  ASN  24           HB3      ASN  24  12.794  -3.851  -2.368
  205   HD21  ASN  24          HD21      ASN  24  13.645  -4.488  -4.228
  206   HD22  ASN  24          HD22      ASN  24  14.682  -5.853  -4.441
  207    H    SER  25           H        SER  25  13.824  -1.592  -2.713
  208    HA   SER  25           HA       SER  25  16.030  -1.842  -4.447
  209    HB2  SER  25           HB2      SER  25  13.969   0.316  -4.034
  210    HB3  SER  25           HB3      SER  25  15.266   0.497  -5.216
  211    HG   SER  25           HG       SER  25  14.495  -1.643  -6.002
  212    H    ILE  26           H        ILE  26  15.304   0.615  -1.972
  213    HA   ILE  26           HA       ILE  26  17.654   2.096  -2.233
  214    HB   ILE  26           HB       ILE  26  15.791   1.686   0.090
  215   HG12  ILE  26          HG12      ILE  26  14.896   3.749  -0.494
  216   HG13  ILE  26          HG13      ILE  26  16.374   4.280  -1.290
  217   HG21  ILE  26          HG21      ILE  26  17.078   3.753   1.012
  218   HG22  ILE  26          HG22      ILE  26  17.708   2.130   1.291
  219   HG23  ILE  26          HG23      ILE  26  18.399   3.137   0.019
  220   HD11  ILE  26          HD11      ILE  26  15.914   2.708  -3.124
  221   HD12  ILE  26          HD12      ILE  26  14.399   2.267  -2.335
  222   HD13  ILE  26          HD13      ILE  26  14.643   3.914  -2.918
  223    H    LEU  27           H        LEU  27  16.940  -0.738  -0.242
  224    HA   LEU  27           HA       LEU  27  19.532  -0.743   1.002
  225    HB2  LEU  27           HB2      LEU  27  17.404  -2.877   0.918
  226    HB3  LEU  27           HB3      LEU  27  18.827  -2.884   1.958
  227    HG   LEU  27           HG       LEU  27  16.810  -0.670   2.122
  228   HD11  LEU  27          HD11      LEU  27  16.514  -3.470   2.990
  229   HD12  LEU  27          HD12      LEU  27  15.289  -2.252   2.634
  230   HD13  LEU  27          HD13      LEU  27  16.118  -2.241   4.191
  231   HD21  LEU  27          HD21      LEU  27  18.751  -1.876   4.091
  232   HD22  LEU  27          HD22      LEU  27  17.653  -0.535   4.419
  233   HD23  LEU  27          HD23      LEU  27  18.948  -0.346   3.236
  234    H    ASN  28           H        ASN  28  18.081  -2.144  -1.823
  235    HA   ASN  28           HA       ASN  28  19.986  -4.211  -2.239
  236    HB2  ASN  28           HB2      ASN  28  17.833  -2.926  -3.841
  237    HB3  ASN  28           HB3      ASN  28  19.079  -3.806  -4.723
  238   HD21  ASN  28          HD21      ASN  28  19.631  -5.954  -3.371
  239   HD22  ASN  28          HD22      ASN  28  18.237  -6.930  -3.073
  240    H    GLY  29           H        GLY  29  19.962  -0.807  -2.855
  241    HA2  GLY  29           HA2      GLY  29  21.787   0.530  -3.396
  242    HA3  GLY  29           HA3      GLY  29  22.725  -0.923  -3.710
  Start of MODEL    4
    1    H1   HIS   1           H        HIS   1 -20.543  -3.547  -5.810
    2    HA   HIS   1           HA       HIS   1 -20.709  -0.828  -5.439
    3    HB2  HIS   1           HB2      HIS   1 -20.857  -2.984  -3.321
    4    HB3  HIS   1           HB3      HIS   1 -21.431  -1.330  -3.122
    5    HD1  HIS   1           HD1      HIS   1 -23.808  -0.938  -3.708
    6    HD2  HIS   1           HD2      HIS   1 -22.321  -4.393  -5.471
    7    HE1  HIS   1           HE1      HIS   1 -25.779  -2.018  -4.836
    8    HE2  HIS   1           HE2      HIS   1 -24.872  -4.151  -5.823
    9    H    SER   2           H        SER   2 -19.395   0.711  -4.708
   10    HA   SER   2           HA       SER   2 -16.994  -0.105  -3.205
   11    HB2  SER   2           HB2      SER   2 -16.766   0.772  -5.670
   12    HB3  SER   2           HB3      SER   2 -17.005   2.352  -4.923
   13    HG   SER   2           HG       SER   2 -15.076   0.510  -3.983
   14    H    ASP   3           H        ASP   3 -16.046   1.678  -1.889
   15    HA   ASP   3           HA       ASP   3 -17.753   3.862  -1.131
   16    HB2  ASP   3           HB2      ASP   3 -17.441   1.461   0.659
   17    HB3  ASP   3           HB3      ASP   3 -17.777   3.060   1.318
   18    H    ALA   4           H        ALA   4 -16.770   4.845   1.036
   19    HA   ALA   4           HA       ALA   4 -14.120   5.603   0.396
   20    HB1  ALA   4           HB1      ALA   4 -15.662   7.107   1.539
   21    HB2  ALA   4           HB2      ALA   4 -15.667   6.045   2.947
   22    HB3  ALA   4           HB3      ALA   4 -14.187   6.880   2.479
   23    H    VAL   5           H        VAL   5 -15.460   3.558   2.977
   24    HA   VAL   5           HA       VAL   5 -13.023   2.973   4.248
   25    HB   VAL   5           HB       VAL   5 -15.238   2.540   5.260
   26   HG11  VAL   5          HG11      VAL   5 -16.104   1.522   3.045
   27   HG12  VAL   5          HG12      VAL   5 -15.414   0.018   3.658
   28   HG13  VAL   5          HG13      VAL   5 -16.671   0.850   4.574
   29   HG21  VAL   5          HG21      VAL   5 -13.363   1.487   6.283
   30   HG22  VAL   5          HG22      VAL   5 -14.658   0.292   6.217
   31   HG23  VAL   5          HG23      VAL   5 -13.330   0.218   5.059
   32    H    PHE   6           H        PHE   6 -14.728   1.386   1.593
   33    HA   PHE   6           HA       PHE   6 -13.115  -0.902   1.409
   34    HB2  PHE   6           HB2      PHE   6 -14.927   0.550  -0.478
   35    HB3  PHE   6           HB3      PHE   6 -13.887  -0.724  -1.107
   36    HD1  PHE   6           HD1      PHE   6 -16.186  -0.165   1.782
   37    HD2  PHE   6           HD2      PHE   6 -14.792  -2.821  -1.237
   38    HE1  PHE   6           HE1      PHE   6 -17.818  -1.852   2.518
   39    HE2  PHE   6           HE2      PHE   6 -16.422  -4.512  -0.507
   40    HZ   PHE   6           HZ       PHE   6 -17.939  -4.029   1.372
   41    H    THR   7           H        THR   7 -12.961   2.125  -0.468
   42    HA   THR   7           HA       THR   7 -10.581   1.457  -1.837
   43    HB   THR   7           HB       THR   7 -12.142   3.195  -2.637
   44    HG1  THR   7           HG1      THR   7  -9.674   4.484  -2.158
   45   HG21  THR   7          HG21      THR   7 -12.231   5.373  -1.624
   46   HG22  THR   7          HG22      THR   7 -11.007   4.922  -0.437
   47   HG23  THR   7          HG23      THR   7 -12.604   4.175  -0.385
   48    H    ASP   8           H        ASP   8 -11.214   3.201   1.162
   49    HA   ASP   8           HA       ASP   8  -8.662   4.233   1.619
   50    HB2  ASP   8           HB2      ASP   8 -10.253   5.076   3.075
   51    HB3  ASP   8           HB3      ASP   8 -10.962   3.493   3.382
   52    H    ASN   9           H        ASN   9 -10.062   1.125   2.628
   53    HA   ASN   9           HA       ASN   9  -7.896   0.144   4.066
   54    HB2  ASN   9           HB2      ASN   9 -10.111  -0.931   4.030
   55    HB3  ASN   9           HB3      ASN   9  -9.845  -1.424   2.360
   56   HD21  ASN   9          HD21      ASN   9  -9.512  -2.270   5.583
   57   HD22  ASN   9          HD22      ASN   9  -8.494  -3.652   5.383
   58    H    TYR  10           H        TYR  10  -8.579  -0.060   0.597
   59    HA   TYR  10           HA       TYR  10  -6.312  -1.655  -0.029
   60    HB2  TYR  10           HB2      TYR  10  -7.801   0.200  -1.892
   61    HB3  TYR  10           HB3      TYR  10  -6.836  -1.204  -2.334
   62    HD1  TYR  10           HD1      TYR  10  -7.786  -3.230  -0.435
   63    HD2  TYR  10           HD2      TYR  10  -9.963  -0.285  -2.602
   64    HE1  TYR  10           HE1      TYR  10  -9.793  -4.647  -0.332
   65    HE2  TYR  10           HE2      TYR  10 -11.977  -1.694  -2.504
   66    HH   TYR  10           HH       TYR  10 -12.045  -4.770  -1.981
   67    H    THR  11           H        THR  11  -6.946   1.825  -0.105
   68    HA   THR  11           HA       THR  11  -4.556   2.650  -1.298
   69    HB   THR  11           HB       THR  11  -6.088   4.178   0.813
   70    HG1  THR  11           HG1      THR  11  -6.484   4.330  -1.995
   71   HG21  THR  11          HG21      THR  11  -3.791   4.981   0.015
   72   HG22  THR  11          HG22      THR  11  -5.127   6.127  -0.087
   73   HG23  THR  11          HG23      THR  11  -4.572   5.287  -1.535
   74    H    ARG  12           H        ARG  12  -5.365   2.178   2.127
   75    HA   ARG  12           HA       ARG  12  -2.805   2.975   3.087
   76    HB2  ARG  12           HB2      ARG  12  -4.787   3.079   4.511
   77    HB3  ARG  12           HB3      ARG  12  -4.972   1.333   4.408
   78    HG2  ARG  12           HG2      ARG  12  -2.412   2.432   5.447
   79    HG3  ARG  12           HG3      ARG  12  -3.839   2.466   6.484
   80    HD2  ARG  12           HD2      ARG  12  -4.036  -0.046   5.690
   81    HD3  ARG  12           HD3      ARG  12  -2.303   0.147   5.429
   82    HE   ARG  12           HE       ARG  12  -1.993   0.185   7.702
   83   HH11  ARG  12          HH12      ARG  12  -5.377   0.580   6.986
   84   HH12  ARG  12          HH11      ARG  12  -5.879   0.414   8.636
   85   HH21  ARG  12          HH22      ARG  12  -2.642  -0.035   9.878
   86   HH22  ARG  12          HH21      ARG  12  -4.322   0.065  10.280
   87    H    LEU  13           H        LEU  13  -4.317  -0.159   2.426
   88    HA   LEU  13           HA       LEU  13  -2.259  -1.792   3.391
   89    HB2  LEU  13           HB2      LEU  13  -4.440  -2.676   2.867
   90    HB3  LEU  13           HB3      LEU  13  -4.238  -2.259   1.167
   91    HG   LEU  13           HG       LEU  13  -2.196  -3.902   1.330
   92   HD11  LEU  13          HD11      LEU  13  -3.644  -5.649   3.053
   93   HD12  LEU  13          HD12      LEU  13  -3.308  -4.146   3.912
   94   HD13  LEU  13          HD13      LEU  13  -1.985  -5.069   3.200
   95   HD21  LEU  13          HD21      LEU  13  -4.128  -5.783   1.105
   96   HD22  LEU  13          HD22      LEU  13  -3.672  -4.670  -0.184
   97   HD23  LEU  13          HD23      LEU  13  -5.065  -4.314   0.837
   98    H    ARG  14           H        ARG  14  -2.749  -0.302   0.227
   99    HA   ARG  14           HA       ARG  14  -0.682  -1.584  -1.155
  100    HB2  ARG  14           HB2      ARG  14  -2.571   0.061  -1.957
  101    HB3  ARG  14           HB3      ARG  14  -1.333   1.284  -1.703
  102    HG2  ARG  14           HG2      ARG  14  -1.253   0.667  -3.987
  103    HG3  ARG  14           HG3      ARG  14   0.161  -0.047  -3.209
  104    HD2  ARG  14           HD2      ARG  14  -0.563  -1.856  -4.392
  105    HD3  ARG  14           HD3      ARG  14  -1.490  -2.093  -2.911
  106    HE   ARG  14           HE       ARG  14  -2.853  -0.529  -4.904
  107   HH11  ARG  14          HH12      ARG  14  -2.182  -3.740  -3.740
  108   HH12  ARG  14          HH11      ARG  14  -3.605  -4.434  -4.444
  109   HH21  ARG  14          HH22      ARG  14  -4.730  -1.430  -5.836
  110   HH22  ARG  14          HH21      ARG  14  -5.053  -3.119  -5.638
  111    H    LYS  15           H        LYS  15  -0.666   1.233   0.952
  112    HA   LYS  15           HA       LYS  15   1.926   2.152   0.394
  113    HB2  LYS  15           HB2      LYS  15   0.226   3.432   1.664
  114    HB3  LYS  15           HB3      LYS  15   0.417   2.317   3.010
  115    HG2  LYS  15           HG2      LYS  15   1.790   3.985   3.707
  116    HG3  LYS  15           HG3      LYS  15   2.950   3.031   2.780
  117    HD2  LYS  15           HD2      LYS  15   1.406   5.142   1.360
  118    HD3  LYS  15           HD3      LYS  15   2.712   5.644   2.438
  119    HE2  LYS  15           HE2      LYS  15   4.165   3.966   1.194
  120    HE3  LYS  15           HE3      LYS  15   2.869   3.887   0.002
  121    HZ1  LYS  15           HZ1      LYS  15   3.410   5.877  -0.828
  122    HZ2  LYS  15           HZ2      LYS  15   4.899   5.645  -0.061
  123    HZ3  LYS  15           HZ3      LYS  15   3.695   6.565   0.691
  124    H    GLN  16           H        GLN  16   0.747  -0.194   2.772
  125    HA   GLN  16           HA       GLN  16   3.208  -0.648   4.056
  126    HB2  GLN  16           HB2      GLN  16   0.608  -2.079   3.875
  127    HB3  GLN  16           HB3      GLN  16   1.995  -2.996   4.447
  128    HG2  GLN  16           HG2      GLN  16   1.416  -0.338   5.655
  129    HG3  GLN  16           HG3      GLN  16   0.439  -1.730   6.118
  130   HE21  GLN  16          HE21      GLN  16   2.910   0.045   7.110
  131   HE22  GLN  16          HE22      GLN  16   3.855  -1.138   7.942
  132    H    MET  17           H        MET  17   1.625  -2.335   1.361
  133    HA   MET  17           HA       MET  17   3.691  -4.255   1.020
  134    HB2  MET  17           HB2      MET  17   1.571  -3.305  -0.914
  135    HB3  MET  17           HB3      MET  17   2.589  -4.719  -1.149
  136    HG2  MET  17           HG2      MET  17   1.609  -5.425   1.175
  137    HG3  MET  17           HG3      MET  17   0.325  -4.301   0.733
  138    HE1  MET  17           HE1      MET  17  -1.139  -7.589   0.572
  139    HE2  MET  17           HE2      MET  17   0.412  -8.383   0.301
  140    HE3  MET  17           HE3      MET  17   0.271  -7.116   1.521
  141    H    ALA  18           H        ALA  18   3.048  -1.083  -0.355
  142    HA   ALA  18           HA       ALA  18   5.097  -1.223  -2.340
  143    HB1  ALA  18           HB1      ALA  18   4.472   0.900  -2.946
  144    HB2  ALA  18           HB2      ALA  18   2.995   0.333  -2.167
  145    HB3  ALA  18           HB3      ALA  18   4.107   1.384  -1.290
  146    H    VAL  19           H        VAL  19   4.986  -0.348   1.018
  147    HA   VAL  19           HA       VAL  19   7.297   1.238   1.181
  148    HB   VAL  19           HB       VAL  19   5.712  -0.361   3.124
  149   HG11  VAL  19          HG11      VAL  19   7.862  -1.023   3.854
  150   HG12  VAL  19          HG12      VAL  19   8.523   0.595   3.613
  151   HG13  VAL  19          HG13      VAL  19   7.370   0.297   4.915
  152   HG21  VAL  19          HG21      VAL  19   5.460   1.745   4.223
  153   HG22  VAL  19          HG22      VAL  19   6.743   2.469   3.252
  154   HG23  VAL  19          HG23      VAL  19   5.217   2.011   2.496
  155    H    LYS  20           H        LYS  20   6.856  -2.264   1.595
  156    HA   LYS  20           HA       LYS  20   9.488  -2.923   2.234
  157    HB2  LYS  20           HB2      LYS  20   7.164  -4.383   1.089
  158    HB3  LYS  20           HB3      LYS  20   8.744  -5.140   0.934
  159    HG2  LYS  20           HG2      LYS  20   7.775  -5.996   2.906
  160    HG3  LYS  20           HG3      LYS  20   9.011  -4.844   3.417
  161    HD2  LYS  20           HD2      LYS  20   7.147  -4.388   4.777
  162    HD3  LYS  20           HD3      LYS  20   7.129  -3.129   3.539
  163    HE2  LYS  20           HE2      LYS  20   4.894  -4.096   3.980
  164    HE3  LYS  20           HE3      LYS  20   5.420  -4.296   2.309
  165    HZ1  LYS  20           HZ1      LYS  20   4.557  -6.270   4.027
  166    HZ2  LYS  20           HZ2      LYS  20   6.225  -6.510   3.887
  167    HZ3  LYS  20           HZ3      LYS  20   5.256  -6.484   2.501
  168    H    LYS  21           H        LYS  21   7.918  -2.642  -0.930
  169    HA   LYS  21           HA       LYS  21  10.029  -3.534  -2.519
  170    HB2  LYS  21           HB2      LYS  21   7.701  -3.096  -3.303
  171    HB3  LYS  21           HB3      LYS  21   8.035  -1.372  -3.217
  172    HG2  LYS  21           HG2      LYS  21   9.851  -3.080  -4.834
  173    HG3  LYS  21           HG3      LYS  21   8.249  -2.705  -5.472
  174    HD2  LYS  21           HD2      LYS  21   8.677  -0.365  -5.392
  175    HD3  LYS  21           HD3      LYS  21  10.157  -0.605  -4.461
  176    HE2  LYS  21           HE2      LYS  21  10.861  -0.175  -6.667
  177    HE3  LYS  21           HE3      LYS  21  11.023  -1.917  -6.452
  178    HZ1  LYS  21           HZ1      LYS  21   9.694  -0.671  -8.476
  179    HZ2  LYS  21           HZ2      LYS  21   8.447  -1.170  -7.448
  180    HZ3  LYS  21           HZ3      LYS  21   9.548  -2.303  -8.052
  181    H    TYR  22           H        TYR  22   9.405  -0.382  -1.093
  182    HA   TYR  22           HA       TYR  22  11.406   1.035  -2.508
  183    HB2  TYR  22           HB2      TYR  22   9.849   1.530   0.004
  184    HB3  TYR  22           HB3      TYR  22  11.209   2.574  -0.394
  185    HD1  TYR  22           HD1      TYR  22   8.575   1.021  -2.541
  186    HD2  TYR  22           HD2      TYR  22  10.356   4.606  -1.100
  187    HE1  TYR  22           HE1      TYR  22   7.123   2.333  -4.030
  188    HE2  TYR  22           HE2      TYR  22   8.908   5.929  -2.584
  189    HH   TYR  22           HH       TYR  22   7.517   5.807  -4.385
  190    H    LEU  23           H        LEU  23  11.375  -0.508   0.691
  191    HA   LEU  23           HA       LEU  23  14.059   0.164   1.326
  192    HB2  LEU  23           HB2      LEU  23  12.561  -2.186   2.440
  193    HB3  LEU  23           HB3      LEU  23  13.815  -1.221   3.214
  194    HG   LEU  23           HG       LEU  23  10.987  -0.343   2.636
  195   HD11  LEU  23          HD11      LEU  23  11.192  -0.144   5.263
  196   HD12  LEU  23          HD12      LEU  23  12.385  -1.420   5.024
  197   HD13  LEU  23          HD13      LEU  23  10.724  -1.654   4.481
  198   HD21  LEU  23          HD21      LEU  23  13.281   1.227   2.868
  199   HD22  LEU  23          HD22      LEU  23  12.495   1.319   4.445
  200   HD23  LEU  23          HD23      LEU  23  11.604   1.762   2.988
  201    H    ASN  24           H        ASN  24  12.541  -2.568  -0.272
  202    HA   ASN  24           HA       ASN  24  14.712  -4.344  -0.229
  203    HB2  ASN  24           HB2      ASN  24  12.816  -5.428  -0.919
  204    HB3  ASN  24           HB3      ASN  24  12.239  -4.050  -1.852
  205   HD21  ASN  24          HD21      ASN  24  12.505  -4.067  -3.982
  206   HD22  ASN  24          HD22      ASN  24  13.457  -5.210  -4.860
  207    H    SER  25           H        SER  25  13.702  -2.028  -2.738
  208    HA   SER  25           HA       SER  25  15.937  -2.527  -4.419
  209    HB2  SER  25           HB2      SER  25  13.651  -1.461  -5.015
  210    HB3  SER  25           HB3      SER  25  14.373   0.043  -4.446
  211    HG   SER  25           HG       SER  25  15.465  -1.632  -6.462
  212    H    ILE  26           H        ILE  26  15.167   0.086  -2.136
  213    HA   ILE  26           HA       ILE  26  17.474   1.612  -2.511
  214    HB   ILE  26           HB       ILE  26  15.789   1.276  -0.030
  215   HG12  ILE  26          HG12      ILE  26  15.826   3.625  -1.911
  216   HG13  ILE  26          HG13      ILE  26  14.813   2.220  -2.230
  217   HG21  ILE  26          HG21      ILE  26  17.156   3.790  -0.185
  218   HG22  ILE  26          HG22      ILE  26  17.190   2.578   1.095
  219   HG23  ILE  26          HG23      ILE  26  18.320   2.466  -0.254
  220   HD11  ILE  26          HD11      ILE  26  14.460   3.100   0.476
  221   HD12  ILE  26          HD12      ILE  26  14.208   4.436  -0.648
  222   HD13  ILE  26          HD13      ILE  26  13.275   2.949  -0.822
  223    H    LEU  27           H        LEU  27  16.816  -0.831   0.003
  224    HA   LEU  27           HA       LEU  27  19.378  -0.778   1.150
  225    HB2  LEU  27           HB2      LEU  27  17.294  -2.950   1.074
  226    HB3  LEU  27           HB3      LEU  27  18.758  -3.029   2.050
  227    HG   LEU  27           HG       LEU  27  16.821  -0.765   2.376
  228   HD11  LEU  27          HD11      LEU  27  15.978  -2.225   4.343
  229   HD12  LEU  27          HD12      LEU  27  16.567  -3.572   3.371
  230   HD13  LEU  27          HD13      LEU  27  15.329  -2.495   2.725
  231   HD21  LEU  27          HD21      LEU  27  18.911  -2.078   4.098
  232   HD22  LEU  27          HD22      LEU  27  17.742  -0.911   4.714
  233   HD23  LEU  27          HD23      LEU  27  18.898  -0.430   3.471
  234    H    ASN  28           H        ASN  28  18.009  -2.752  -1.442
  235    HA   ASN  28           HA       ASN  28  19.967  -4.633  -1.808
  236    HB2  ASN  28           HB2      ASN  28  17.937  -4.638  -3.134
  237    HB3  ASN  28           HB3      ASN  28  18.407  -3.136  -3.924
  238   HD21  ASN  28          HD21      ASN  28  19.346  -6.502  -3.474
  239   HD22  ASN  28          HD22      ASN  28  20.139  -6.673  -4.999
  240    H    GLY  29           H        GLY  29  20.000  -1.251  -2.808
  241    HA2  GLY  29           HA2      GLY  29  22.543  -1.535  -4.170
  242    HA3  GLY  29           HA3      GLY  29  21.630  -0.048  -3.958
  Start of MODEL    5
    1    H1   HIS   1           H        HIS   1 -22.907   1.265  -2.736
    2    HA   HIS   1           HA       HIS   1 -22.067   3.974  -2.196
    3    HB2  HIS   1           HB2      HIS   1 -23.798   3.948  -0.467
    4    HB3  HIS   1           HB3      HIS   1 -24.434   3.332  -1.990
    5    HD1  HIS   1           HD1      HIS   1 -25.932   1.421  -1.597
    6    HD2  HIS   1           HD2      HIS   1 -22.798   1.492   1.130
    7    HE1  HIS   1           HE1      HIS   1 -26.278  -0.587  -0.122
    8    HE2  HIS   1           HE2      HIS   1 -24.419  -0.475   1.573
    9    H    SER   2           H        SER   2 -21.108   4.720  -0.284
   10    HA   SER   2           HA       SER   2 -19.617   4.693   1.433
   11    HB2  SER   2           HB2      SER   2 -21.027   2.070   1.909
   12    HB3  SER   2           HB3      SER   2 -19.746   2.648   2.974
   13    HG   SER   2           HG       SER   2 -22.338   3.404   2.845
   14    H    ASP   3           H        ASP   3 -18.614   4.016  -1.057
   15    HA   ASP   3           HA       ASP   3 -16.973   1.659  -0.860
   16    HB2  ASP   3           HB2      ASP   3 -17.221   3.888  -2.865
   17    HB3  ASP   3           HB3      ASP   3 -15.911   2.715  -2.971
   18    H    ALA   4           H        ALA   4 -16.759   4.825   0.289
   19    HA   ALA   4           HA       ALA   4 -14.090   5.501   0.069
   20    HB1  ALA   4           HB1      ALA   4 -16.304   6.223   1.808
   21    HB2  ALA   4           HB2      ALA   4 -14.741   6.324   2.618
   22    HB3  ALA   4           HB3      ALA   4 -15.022   7.227   1.130
   23    H    VAL   5           H        VAL   5 -15.638   3.479   2.549
   24    HA   VAL   5           HA       VAL   5 -13.314   2.981   4.058
   25    HB   VAL   5           HB       VAL   5 -15.578   2.553   4.918
   26   HG11  VAL   5          HG11      VAL   5 -16.343   1.551   2.685
   27   HG12  VAL   5          HG12      VAL   5 -15.651   0.041   3.279
   28   HG13  VAL   5          HG13      VAL   5 -16.958   0.823   4.169
   29   HG21  VAL   5          HG21      VAL   5 -13.791   1.487   6.078
   30   HG22  VAL   5          HG22      VAL   5 -15.095   0.308   5.934
   31   HG23  VAL   5          HG23      VAL   5 -13.691   0.204   4.871
   32    H    PHE   6           H        PHE   6 -14.758   1.299   1.312
   33    HA   PHE   6           HA       PHE   6 -13.094  -0.970   1.352
   34    HB2  PHE   6           HB2      PHE   6 -14.676   0.372  -0.832
   35    HB3  PHE   6           HB3      PHE   6 -13.714  -1.070  -1.139
   36    HD1  PHE   6           HD1      PHE   6 -16.374   0.211   1.129
   37    HD2  PHE   6           HD2      PHE   6 -14.667  -3.150  -0.847
   38    HE1  PHE   6           HE1      PHE   6 -18.239  -1.191   1.910
   39    HE2  PHE   6           HE2      PHE   6 -16.529  -4.557  -0.071
   40    HZ   PHE   6           HZ       PHE   6 -18.319  -3.578   1.309
   41    H    THR   7           H        THR   7 -12.882   1.984  -0.631
   42    HA   THR   7           HA       THR   7 -10.390   1.323  -1.797
   43    HB   THR   7           HB       THR   7 -11.915   2.963  -2.813
   44    HG1  THR   7           HG1      THR   7  -9.259   3.627  -2.175
   45   HG21  THR   7          HG21      THR   7 -12.307   5.109  -1.910
   46   HG22  THR   7          HG22      THR   7 -11.053   4.910  -0.686
   47   HG23  THR   7          HG23      THR   7 -12.552   3.988  -0.571
   48    H    ASP   8           H        ASP   8 -11.294   3.191   1.055
   49    HA   ASP   8           HA       ASP   8  -8.838   4.349   1.654
   50    HB2  ASP   8           HB2      ASP   8 -10.498   5.159   3.020
   51    HB3  ASP   8           HB3      ASP   8 -11.236   3.574   3.242
   52    H    ASN   9           H        ASN   9 -10.035   1.105   2.302
   53    HA   ASN   9           HA       ASN   9  -7.886   0.322   3.991
   54    HB2  ASN   9           HB2      ASN   9 -10.044  -0.848   4.008
   55    HB3  ASN   9           HB3      ASN   9  -9.779  -1.376   2.350
   56   HD21  ASN   9          HD21      ASN   9 -10.125  -2.840   4.923
   57   HD22  ASN   9          HD22      ASN   9  -8.772  -3.911   5.008
   58    H    TYR  10           H        TYR  10  -8.524  -0.003   0.528
   59    HA   TYR  10           HA       TYR  10  -6.265  -1.593  -0.068
   60    HB2  TYR  10           HB2      TYR  10  -7.707   0.325  -1.908
   61    HB3  TYR  10           HB3      TYR  10  -6.697  -1.033  -2.389
   62    HD1  TYR  10           HD1      TYR  10  -7.725  -3.053  -0.387
   63    HD2  TYR  10           HD2      TYR  10  -9.753  -0.293  -2.912
   64    HE1  TYR  10           HE1      TYR  10  -9.698  -4.521  -0.397
   65    HE2  TYR  10           HE2      TYR  10 -11.732  -1.753  -2.927
   66    HH   TYR  10           HH       TYR  10 -11.710  -4.888  -2.066
   67    H    THR  11           H        THR  11  -6.815   1.907  -0.159
   68    HA   THR  11           HA       THR  11  -4.368   2.684  -1.250
   69    HB   THR  11           HB       THR  11  -4.744   4.864  -0.062
   70    HG1  THR  11           HG1      THR  11  -6.868   4.982   0.994
   71   HG21  THR  11          HG21      THR  11  -5.928   5.322  -1.892
   72   HG22  THR  11          HG22      THR  11  -7.365   4.656  -1.118
   73   HG23  THR  11          HG23      THR  11  -6.321   3.614  -2.084
   74    H    ARG  12           H        ARG  12  -5.289   2.175   2.140
   75    HA   ARG  12           HA       ARG  12  -2.756   2.916   3.200
   76    HB2  ARG  12           HB2      ARG  12  -5.121   1.427   4.316
   77    HB3  ARG  12           HB3      ARG  12  -3.644   1.635   5.248
   78    HG2  ARG  12           HG2      ARG  12  -3.913   4.127   4.826
   79    HG3  ARG  12           HG3      ARG  12  -5.544   3.741   4.274
   80    HD2  ARG  12           HD2      ARG  12  -6.114   2.815   6.409
   81    HD3  ARG  12           HD3      ARG  12  -4.447   2.954   6.967
   82    HE   ARG  12           HE       ARG  12  -5.491   5.484   6.210
   83   HH11  ARG  12          HH12      ARG  12  -5.570   3.099   8.745
   84   HH12  ARG  12          HH11      ARG  12  -5.947   4.244   9.990
   85   HH21  ARG  12          HH22      ARG  12  -5.987   7.001   7.840
   86   HH22  ARG  12          HH21      ARG  12  -6.185   6.464   9.473
   87    H    LEU  13           H        LEU  13  -4.227  -0.154   2.273
   88    HA   LEU  13           HA       LEU  13  -2.224  -1.846   3.301
   89    HB2  LEU  13           HB2      LEU  13  -4.353  -2.746   2.694
   90    HB3  LEU  13           HB3      LEU  13  -4.170  -2.193   1.030
   91    HG   LEU  13           HG       LEU  13  -2.088  -3.820   1.088
   92   HD11  LEU  13          HD11      LEU  13  -2.895  -5.884   2.407
   93   HD12  LEU  13          HD12      LEU  13  -3.829  -4.723   3.350
   94   HD13  LEU  13          HD13      LEU  13  -2.072  -4.589   3.277
   95   HD21  LEU  13          HD21      LEU  13  -4.262  -3.869  -0.280
   96   HD22  LEU  13          HD22      LEU  13  -4.814  -5.056   0.902
   97   HD23  LEU  13          HD23      LEU  13  -3.377  -5.380  -0.069
   98    H    ARG  14           H        ARG  14  -2.563  -0.169   0.222
   99    HA   ARG  14           HA       ARG  14  -0.494  -1.426  -1.179
  100    HB2  ARG  14           HB2      ARG  14  -2.305   0.370  -1.893
  101    HB3  ARG  14           HB3      ARG  14  -0.989   1.490  -1.570
  102    HG2  ARG  14           HG2      ARG  14   0.426   0.206  -3.150
  103    HG3  ARG  14           HG3      ARG  14  -0.981  -0.788  -3.536
  104    HD2  ARG  14           HD2      ARG  14  -1.232   2.171  -3.727
  105    HD3  ARG  14           HD3      ARG  14  -0.338   1.321  -4.987
  106    HE   ARG  14           HE       ARG  14  -2.659  -0.076  -4.779
  107   HH11  ARG  14          HH12      ARG  14  -1.880   3.279  -5.289
  108   HH12  ARG  14          HH11      ARG  14  -3.301   3.601  -6.227
  109   HH21  ARG  14          HH22      ARG  14  -4.533   0.336  -6.013
  110   HH22  ARG  14          HH21      ARG  14  -4.810   1.927  -6.637
  111    H    LYS  15           H        LYS  15  -0.456   1.240   1.116
  112    HA   LYS  15           HA       LYS  15   2.162   2.134   0.713
  113    HB2  LYS  15           HB2      LYS  15   0.703   3.464   2.041
  114    HB3  LYS  15           HB3      LYS  15   0.386   2.136   3.150
  115    HG2  LYS  15           HG2      LYS  15   1.853   3.782   4.160
  116    HG3  LYS  15           HG3      LYS  15   2.691   2.244   3.947
  117    HD2  LYS  15           HD2      LYS  15   4.188   3.990   3.294
  118    HD3  LYS  15           HD3      LYS  15   3.659   3.159   1.829
  119    HE2  LYS  15           HE2      LYS  15   3.625   5.534   1.442
  120    HE3  LYS  15           HE3      LYS  15   1.968   4.935   1.487
  121    HZ1  LYS  15           HZ1      LYS  15   2.735   7.066   2.823
  122    HZ2  LYS  15           HZ2      LYS  15   3.101   5.903   3.995
  123    HZ3  LYS  15           HZ3      LYS  15   1.523   6.034   3.399
  124    H    GLN  16           H        GLN  16   0.898  -0.475   2.729
  125    HA   GLN  16           HA       GLN  16   3.307  -1.085   4.060
  126    HB2  GLN  16           HB2      GLN  16   0.789  -2.625   3.506
  127    HB3  GLN  16           HB3      GLN  16   2.161  -3.403   4.284
  128    HG2  GLN  16           HG2      GLN  16   0.962  -0.864   5.335
  129    HG3  GLN  16           HG3      GLN  16   0.349  -2.454   5.785
  130   HE21  GLN  16          HE21      GLN  16   2.746  -0.093   6.299
  131   HE22  GLN  16          HE22      GLN  16   3.673  -0.952   7.477
  132    H    MET  17           H        MET  17   1.833  -2.417   1.117
  133    HA   MET  17           HA       MET  17   3.907  -4.295   0.625
  134    HB2  MET  17           HB2      MET  17   1.891  -3.096  -1.283
  135    HB3  MET  17           HB3      MET  17   2.893  -4.502  -1.614
  136    HG2  MET  17           HG2      MET  17   1.129  -4.513   0.783
  137    HG3  MET  17           HG3      MET  17   0.423  -4.769  -0.811
  138    HE1  MET  17           HE1      MET  17   1.837  -6.204  -2.520
  139    HE2  MET  17           HE2      MET  17   2.284  -7.863  -2.120
  140    HE3  MET  17           HE3      MET  17   0.594  -7.361  -2.044
  141    H    ALA  18           H        ALA  18   3.323  -0.976  -0.386
  142    HA   ALA  18           HA       ALA  18   5.459  -0.887  -2.278
  143    HB1  ALA  18           HB1      ALA  18   3.313   0.724  -1.699
  144    HB2  ALA  18           HB2      ALA  18   4.685   1.679  -1.134
  145    HB3  ALA  18           HB3      ALA  18   4.630   1.119  -2.805
  146    H    VAL  19           H        VAL  19   5.147  -0.224   1.147
  147    HA   VAL  19           HA       VAL  19   7.525   1.218   1.535
  148    HB   VAL  19           HB       VAL  19   5.727  -0.368   3.298
  149   HG11  VAL  19          HG11      VAL  19   7.325   0.224   5.212
  150   HG12  VAL  19          HG12      VAL  19   7.727  -1.170   4.208
  151   HG13  VAL  19          HG13      VAL  19   8.560   0.366   3.962
  152   HG21  VAL  19          HG21      VAL  19   4.990   1.672   3.768
  153   HG22  VAL  19          HG22      VAL  19   6.585   2.129   4.365
  154   HG23  VAL  19          HG23      VAL  19   6.183   2.354   2.662
  155    H    LYS  20           H        LYS  20   6.864  -2.267   1.767
  156    HA   LYS  20           HA       LYS  20   9.494  -3.018   2.475
  157    HB2  LYS  20           HB2      LYS  20   7.072  -4.430   1.464
  158    HB3  LYS  20           HB3      LYS  20   8.614  -5.270   1.360
  159    HG2  LYS  20           HG2      LYS  20   8.805  -5.496   3.614
  160    HG3  LYS  20           HG3      LYS  20   7.906  -4.015   3.951
  161    HD2  LYS  20           HD2      LYS  20   6.584  -6.455   2.797
  162    HD3  LYS  20           HD3      LYS  20   6.780  -6.233   4.537
  163    HE2  LYS  20           HE2      LYS  20   5.721  -3.867   3.964
  164    HE3  LYS  20           HE3      LYS  20   5.052  -4.775   2.609
  165    HZ1  LYS  20           HZ1      LYS  20   4.271  -6.423   4.324
  166    HZ2  LYS  20           HZ2      LYS  20   3.486  -4.925   4.333
  167    HZ3  LYS  20           HZ3      LYS  20   4.660  -5.272   5.501
  168    H    LYS  21           H        LYS  21   7.836  -2.750  -0.637
  169    HA   LYS  21           HA       LYS  21   9.916  -3.828  -2.214
  170    HB2  LYS  21           HB2      LYS  21   7.569  -2.044  -2.802
  171    HB3  LYS  21           HB3      LYS  21   8.743  -2.430  -4.054
  172    HG2  LYS  21           HG2      LYS  21   7.331  -4.556  -2.475
  173    HG3  LYS  21           HG3      LYS  21   6.655  -3.861  -3.950
  174    HD2  LYS  21           HD2      LYS  21   9.423  -5.032  -3.850
  175    HD3  LYS  21           HD3      LYS  21   7.996  -6.015  -4.192
  176    HE2  LYS  21           HE2      LYS  21   8.719  -3.536  -5.743
  177    HE3  LYS  21           HE3      LYS  21   9.236  -5.156  -6.208
  178    HZ1  LYS  21           HZ1      LYS  21   6.607  -3.928  -6.378
  179    HZ2  LYS  21           HZ2      LYS  21   6.633  -5.554  -5.917
  180    HZ3  LYS  21           HZ3      LYS  21   7.331  -5.080  -7.383
  181    H    TYR  22           H        TYR  22   9.165  -0.541  -1.166
  182    HA   TYR  22           HA       TYR  22  11.139   0.752  -2.728
  183    HB2  TYR  22           HB2      TYR  22   9.648   1.546  -0.232
  184    HB3  TYR  22           HB3      TYR  22  10.846   2.599  -0.977
  185    HD1  TYR  22           HD2      TYR  22  10.396   2.450  -3.783
  186    HD2  TYR  22           HD1      TYR  22   7.523   2.337  -0.647
  187    HE1  TYR  22           HE2      TYR  22   8.686   3.310  -5.327
  188    HE2  TYR  22           HE1      TYR  22   5.805   3.196  -2.182
  189    HH   TYR  22           HH       TYR  22   6.375   3.485  -5.601
  190    H    LEU  23           H        LEU  23  11.101  -0.132   0.726
  191    HA   LEU  23           HA       LEU  23  13.713   0.661   1.314
  192    HB2  LEU  23           HB2      LEU  23  13.548  -0.837   3.247
  193    HB3  LEU  23           HB3      LEU  23  12.113   0.168   3.048
  194    HG   LEU  23           HG       LEU  23  11.105  -1.905   1.878
  195   HD11  LEU  23          HD11      LEU  23  13.657  -2.899   2.382
  196   HD12  LEU  23          HD12      LEU  23  12.245  -3.809   1.846
  197   HD13  LEU  23          HD13      LEU  23  12.614  -3.688   3.566
  198   HD21  LEU  23          HD21      LEU  23   9.980  -1.540   3.789
  199   HD22  LEU  23          HD22      LEU  23  11.449  -1.265   4.725
  200   HD23  LEU  23          HD23      LEU  23  10.914  -2.912   4.386
  201    H    ASN  24           H        ASN  24  12.462  -2.348  -0.013
  202    HA   ASN  24           HA       ASN  24  14.865  -3.832   0.199
  203    HB2  ASN  24           HB2      ASN  24  12.715  -4.940  -0.113
  204    HB3  ASN  24           HB3      ASN  24  12.520  -4.168  -1.684
  205   HD21  ASN  24          HD21      ASN  24  13.711  -4.897  -3.430
  206   HD22  ASN  24          HD22      ASN  24  14.554  -6.405  -3.410
  207    H    SER  25           H        SER  25  13.553  -1.687  -2.255
  208    HA   SER  25           HA       SER  25  15.459  -2.311  -4.270
  209    HB2  SER  25           HB2      SER  25  13.782   0.184  -3.905
  210    HB3  SER  25           HB3      SER  25  14.648  -0.263  -5.375
  211    HG   SER  25           HG       SER  25  12.306  -1.302  -4.297
  212    H    ILE  26           H        ILE  26  15.223   0.303  -1.879
  213    HA   ILE  26           HA       ILE  26  17.625   1.594  -2.663
  214    HB   ILE  26           HB       ILE  26  15.932   1.741  -0.185
  215   HG12  ILE  26          HG12      ILE  26  15.211   3.795  -1.025
  216   HG13  ILE  26          HG13      ILE  26  16.639   3.996  -2.034
  217   HG21  ILE  26          HG21      ILE  26  18.620   2.970  -0.679
  218   HG22  ILE  26          HG22      ILE  26  17.439   3.747   0.374
  219   HG23  ILE  26          HG23      ILE  26  18.029   2.129   0.754
  220   HD11  ILE  26          HD11      ILE  26  14.514   1.932  -2.539
  221   HD12  ILE  26          HD12      ILE  26  14.536   3.534  -3.277
  222   HD13  ILE  26          HD13      ILE  26  15.841   2.395  -3.603
  223    H    LEU  27           H        LEU  27  16.883  -1.003  -0.444
  224    HA   LEU  27           HA       LEU  27  19.484  -0.984   0.796
  225    HB2  LEU  27           HB2      LEU  27  17.258  -3.016   0.879
  226    HB3  LEU  27           HB3      LEU  27  18.719  -3.076   1.863
  227    HG   LEU  27           HG       LEU  27  16.966  -0.669   2.036
  228   HD11  LEU  27          HD11      LEU  27  16.403  -3.010   3.793
  229   HD12  LEU  27          HD12      LEU  27  15.648  -2.923   2.202
  230   HD13  LEU  27          HD13      LEU  27  15.376  -1.637   3.378
  231   HD21  LEU  27          HD21      LEU  27  18.177  -0.234   3.861
  232   HD22  LEU  27          HD22      LEU  27  19.289  -1.466   3.264
  233   HD23  LEU  27          HD23      LEU  27  18.052  -1.893   4.448
  234    H    ASN  28           H        ASN  28  17.802  -2.934  -1.632
  235    HA   ASN  28           HA       ASN  28  20.112  -4.630  -2.039
  236    HB2  ASN  28           HB2      ASN  28  18.740  -5.982  -3.298
  237    HB3  ASN  28           HB3      ASN  28  17.535  -5.194  -2.284
  238   HD21  ASN  28          HD21      ASN  28  15.807  -4.669  -3.388
  239   HD22  ASN  28          HD22      ASN  28  15.769  -4.082  -5.013
  240    H    GLY  29           H        GLY  29  18.847  -1.702  -3.312
  241    HA2  GLY  29           HA2      GLY  29  19.563  -1.550  -5.912
  242    HA3  GLY  29           HA3      GLY  29  19.844  -0.227  -4.791
  Start of MODEL    6
    1    H1   HIS   1           H        HIS   1 -19.408  -4.758  -3.429
    2    HA   HIS   1           HA       HIS   1 -20.079  -2.225  -3.992
    3    HB2  HIS   1           HB2      HIS   1 -19.630  -3.629  -1.406
    4    HB3  HIS   1           HB3      HIS   1 -19.867  -1.884  -1.350
    5    HD1  HIS   1           HD1      HIS   1 -21.890  -4.052  -0.231
    6    HD2  HIS   1           HD2      HIS   1 -22.210  -2.040  -3.852
    7    HE1  HIS   1           HE1      HIS   1 -24.333  -4.119  -0.824
    8    HE2  HIS   1           HE2      HIS   1 -24.490  -2.971  -3.060
    9    H    SER   2           H        SER   2 -18.813  -0.659  -4.759
   10    HA   SER   2           HA       SER   2 -16.159  -0.242  -3.605
   11    HB2  SER   2           HB2      SER   2 -17.499   0.567  -6.154
   12    HB3  SER   2           HB3      SER   2 -16.156   1.542  -5.557
   13    HG   SER   2           HG       SER   2 -15.885  -1.249  -5.687
   14    H    ASP   3           H        ASP   3 -16.292   0.908  -1.767
   15    HA   ASP   3           HA       ASP   3 -17.727   3.479  -1.884
   16    HB2  ASP   3           HB2      ASP   3 -18.598   1.541  -0.319
   17    HB3  ASP   3           HB3      ASP   3 -17.294   2.092   0.729
   18    H    ALA   4           H        ALA   4 -16.887   4.981  -0.061
   19    HA   ALA   4           HA       ALA   4 -14.189   5.561  -0.600
   20    HB1  ALA   4           HB1      ALA   4 -14.462   7.137   1.402
   21    HB2  ALA   4           HB2      ALA   4 -15.511   7.388   0.007
   22    HB3  ALA   4           HB3      ALA   4 -16.134   6.577   1.444
   23    H    VAL   5           H        VAL   5 -15.753   3.943   2.125
   24    HA   VAL   5           HA       VAL   5 -13.439   3.739   3.746
   25    HB   VAL   5           HB       VAL   5 -15.597   3.478   4.766
   26   HG11  VAL   5          HG11      VAL   5 -17.275   2.241   3.954
   27   HG12  VAL   5          HG12      VAL   5 -16.294   2.110   2.493
   28   HG13  VAL   5          HG13      VAL   5 -16.239   0.835   3.710
   29   HG21  VAL   5          HG21      VAL   5 -13.966   2.314   5.980
   30   HG22  VAL   5          HG22      VAL   5 -15.296   1.167   5.823
   31   HG23  VAL   5          HG23      VAL   5 -13.877   1.017   4.788
   32    H    PHE   6           H        PHE   6 -14.870   1.643   1.297
   33    HA   PHE   6           HA       PHE   6 -13.228  -0.603   1.735
   34    HB2  PHE   6           HB2      PHE   6 -14.890   0.368  -0.561
   35    HB3  PHE   6           HB3      PHE   6 -13.813  -1.006  -0.790
   36    HD1  PHE   6           HD1      PHE   6 -16.541   0.231   1.412
   37    HD2  PHE   6           HD2      PHE   6 -14.521  -3.137  -0.229
   38    HE1  PHE   6           HE1      PHE   6 -18.244  -1.257   2.380
   39    HE2  PHE   6           HE2      PHE   6 -16.222  -4.631   0.735
   40    HZ   PHE   6           HZ       PHE   6 -18.087  -3.691   2.040
   41    H    THR   7           H        THR   7 -12.984   1.970  -0.719
   42    HA   THR   7           HA       THR   7 -10.507   1.114  -1.763
   43    HB   THR   7           HB       THR   7 -12.009   2.623  -2.997
   44    HG1  THR   7           HG1      THR   7  -9.486   2.651  -3.045
   45   HG21  THR   7          HG21      THR   7 -12.526   4.770  -2.358
   46   HG22  THR   7          HG22      THR   7 -11.068   4.947  -1.382
   47   HG23  THR   7          HG23      THR   7 -12.420   3.989  -0.781
   48    H    ASP   8           H        ASP   8 -11.357   3.385   0.797
   49    HA   ASP   8           HA       ASP   8  -8.857   4.550   1.210
   50    HB2  ASP   8           HB2      ASP   8 -10.540   5.611   2.388
   51    HB3  ASP   8           HB3      ASP   8 -11.262   4.096   2.926
   52    H    ASN   9           H        ASN   9 -10.228   1.558   2.505
   53    HA   ASN   9           HA       ASN   9  -8.061   0.968   4.237
   54    HB2  ASN   9           HB2      ASN   9  -9.184  -0.979   4.736
   55    HB3  ASN   9           HB3      ASN   9 -10.511  -0.020   4.088
   56   HD21  ASN   9          HD21      ASN   9 -11.773  -1.156   2.824
   57   HD22  ASN   9          HD22      ASN   9 -11.278  -2.405   1.737
   58    H    TYR  10           H        TYR  10  -8.847   0.008   0.923
   59    HA   TYR  10           HA       TYR  10  -6.707  -1.798   0.583
   60    HB2  TYR  10           HB2      TYR  10  -8.115  -0.162  -1.536
   61    HB3  TYR  10           HB3      TYR  10  -7.169  -1.622  -1.804
   62    HD1  TYR  10           HD1      TYR  10  -8.168  -3.289   0.467
   63    HD2  TYR  10           HD2      TYR  10 -10.245  -0.798  -2.287
   64    HE1  TYR  10           HE1      TYR  10 -10.190  -4.658   0.764
   65    HE2  TYR  10           HE2      TYR  10 -12.273  -2.159  -1.997
   66    HH   TYR  10           HH       TYR  10 -12.667  -4.362   0.501
   67    H    THR  11           H        THR  11  -7.028   1.663  -0.069
   68    HA   THR  11           HA       THR  11  -4.587   2.065  -1.372
   69    HB   THR  11           HB       THR  11  -5.991   4.031   0.446
   70    HG1  THR  11           HG1      THR  11  -7.190   2.997  -1.422
   71   HG21  THR  11          HG21      THR  11  -4.469   5.530  -0.191
   72   HG22  THR  11          HG22      THR  11  -4.723   5.135  -1.891
   73   HG23  THR  11          HG23      THR  11  -3.559   4.217  -0.936
   74    H    ARG  12           H        ARG  12  -5.396   2.276   2.082
   75    HA   ARG  12           HA       ARG  12  -2.822   3.029   2.954
   76    HB2  ARG  12           HB2      ARG  12  -5.225   1.834   4.284
   77    HB3  ARG  12           HB3      ARG  12  -3.707   1.941   5.166
   78    HG2  ARG  12           HG2      ARG  12  -3.698   4.285   5.085
   79    HG3  ARG  12           HG3      ARG  12  -4.937   4.327   3.829
   80    HD2  ARG  12           HD2      ARG  12  -6.177   4.861   5.689
   81    HD3  ARG  12           HD3      ARG  12  -6.385   3.111   5.635
   82    HE   ARG  12           HE       ARG  12  -4.925   4.636   7.611
   83   HH11  ARG  12          HH12      ARG  12  -5.503   1.511   6.188
   84   HH12  ARG  12          HH11      ARG  12  -4.933   0.632   7.568
   85   HH21  ARG  12          HH22      ARG  12  -4.171   3.490   9.434
   86   HH22  ARG  12          HH21      ARG  12  -4.176   1.759   9.414
   87    H    LEU  13           H        LEU  13  -4.390  -0.134   2.643
   88    HA   LEU  13           HA       LEU  13  -2.348  -1.681   3.775
   89    HB2  LEU  13           HB2      LEU  13  -4.554  -2.576   3.374
   90    HB3  LEU  13           HB3      LEU  13  -4.355  -2.369   1.635
   91    HG   LEU  13           HG       LEU  13  -2.356  -4.022   1.960
   92   HD11  LEU  13          HD11      LEU  13  -3.585  -5.619   3.865
   93   HD12  LEU  13          HD12      LEU  13  -3.593  -4.004   4.572
   94   HD13  LEU  13          HD13      LEU  13  -2.073  -4.729   4.047
   95   HD21  LEU  13          HD21      LEU  13  -4.320  -4.491   0.617
   96   HD22  LEU  13          HD22      LEU  13  -5.244  -4.887   2.067
   97   HD23  LEU  13          HD23      LEU  13  -3.888  -5.905   1.579
   98    H    ARG  14           H        ARG  14  -2.807  -0.460   0.507
   99    HA   ARG  14           HA       ARG  14  -0.820  -1.956  -0.784
  100    HB2  ARG  14           HB2      ARG  14  -2.636  -0.358  -1.747
  101    HB3  ARG  14           HB3      ARG  14  -1.412   0.888  -1.536
  102    HG2  ARG  14           HG2      ARG  14   0.068  -0.886  -2.844
  103    HG3  ARG  14           HG3      ARG  14  -1.518  -1.368  -3.449
  104    HD2  ARG  14           HD2      ARG  14  -0.805   0.225  -4.991
  105    HD3  ARG  14           HD3      ARG  14  -1.870   1.133  -3.919
  106    HE   ARG  14           HE       ARG  14   0.510   1.561  -2.789
  107   HH11  ARG  14          HH12      ARG  14  -0.518   1.739  -6.110
  108   HH12  ARG  14          HH11      ARG  14   0.623   2.973  -6.533
  109   HH21  ARG  14          HH22      ARG  14   2.017   3.184  -3.334
  110   HH22  ARG  14          HH21      ARG  14   2.065   3.793  -4.954
  111    H    LYS  15           H        LYS  15  -0.656   1.025   1.076
  112    HA   LYS  15           HA       LYS  15   1.929   1.840   0.425
  113    HB2  LYS  15           HB2      LYS  15   0.222   3.115   1.778
  114    HB3  LYS  15           HB3      LYS  15   0.653   2.102   3.150
  115    HG2  LYS  15           HG2      LYS  15   1.973   3.920   3.540
  116    HG3  LYS  15           HG3      LYS  15   3.080   2.923   2.593
  117    HD2  LYS  15           HD2      LYS  15   1.293   4.898   1.229
  118    HD3  LYS  15           HD3      LYS  15   2.786   5.439   2.000
  119    HE2  LYS  15           HE2      LYS  15   3.798   3.413   0.635
  120    HE3  LYS  15           HE3      LYS  15   2.389   3.703  -0.384
  121    HZ1  LYS  15           HZ1      LYS  15   3.173   6.131  -0.322
  122    HZ2  LYS  15           HZ2      LYS  15   4.006   5.043  -1.313
  123    HZ3  LYS  15           HZ3      LYS  15   4.659   5.497   0.180
  124    H    GLN  16           H        GLN  16   0.813  -0.428   2.907
  125    HA   GLN  16           HA       GLN  16   3.297  -0.888   4.127
  126    HB2  GLN  16           HB2      GLN  16   0.746  -2.450   3.942
  127    HB3  GLN  16           HB3      GLN  16   2.166  -3.176   4.681
  128    HG2  GLN  16           HG2      GLN  16   0.588  -2.110   6.281
  129    HG3  GLN  16           HG3      GLN  16   2.244  -1.511   6.370
  130   HE21  GLN  16          HE21      GLN  16   2.710   0.528   5.340
  131   HE22  GLN  16          HE22      GLN  16   1.472   1.727   5.219
  132    H    MET  17           H        MET  17   1.662  -2.599   1.479
  133    HA   MET  17           HA       MET  17   3.726  -4.516   1.112
  134    HB2  MET  17           HB2      MET  17   1.607  -3.598  -0.840
  135    HB3  MET  17           HB3      MET  17   2.574  -5.060  -0.982
  136    HG2  MET  17           HG2      MET  17   1.545  -5.554   1.394
  137    HG3  MET  17           HG3      MET  17   0.294  -4.456   0.817
  138    HE1  MET  17           HE1      MET  17   0.580  -7.471   1.730
  139    HE2  MET  17           HE2      MET  17  -1.104  -7.470   1.207
  140    HE3  MET  17           HE3      MET  17   0.028  -8.646   0.536
  141    H    ALA  18           H        ALA  18   3.046  -1.357  -0.273
  142    HA   ALA  18           HA       ALA  18   5.048  -1.510  -2.304
  143    HB1  ALA  18           HB1      ALA  18   4.516   1.196  -1.683
  144    HB2  ALA  18           HB2      ALA  18   3.914   0.246  -3.042
  145    HB3  ALA  18           HB3      ALA  18   2.998   0.310  -1.537
  146    H    VAL  19           H        VAL  19   5.016  -0.624   1.050
  147    HA   VAL  19           HA       VAL  19   7.319   0.979   1.154
  148    HB   VAL  19           HB       VAL  19   5.797  -0.633   3.137
  149   HG11  VAL  19          HG11      VAL  19   7.505   0.064   4.881
  150   HG12  VAL  19          HG12      VAL  19   7.956  -1.280   3.830
  151   HG13  VAL  19          HG13      VAL  19   8.617   0.329   3.538
  152   HG21  VAL  19          HG21      VAL  19   6.362   2.181   2.522
  153   HG22  VAL  19          HG22      VAL  19   4.929   1.440   3.235
  154   HG23  VAL  19          HG23      VAL  19   6.334   1.791   4.242
  155    H    LYS  20           H        LYS  20   6.912  -2.527   1.545
  156    HA   LYS  20           HA       LYS  20   9.553  -3.180   2.141
  157    HB2  LYS  20           HB2      LYS  20   7.291  -4.672   0.861
  158    HB3  LYS  20           HB3      LYS  20   8.887  -5.407   0.936
  159    HG2  LYS  20           HG2      LYS  20   8.805  -5.696   3.187
  160    HG3  LYS  20           HG3      LYS  20   7.788  -4.276   3.444
  161    HD2  LYS  20           HD2      LYS  20   6.777  -6.772   2.102
  162    HD3  LYS  20           HD3      LYS  20   6.709  -6.540   3.851
  163    HE2  LYS  20           HE2      LYS  20   5.642  -4.379   2.112
  164    HE3  LYS  20           HE3      LYS  20   4.699  -5.861   2.258
  165    HZ1  LYS  20           HZ1      LYS  20   4.381  -5.536   4.510
  166    HZ2  LYS  20           HZ2      LYS  20   4.278  -3.959   3.908
  167    HZ3  LYS  20           HZ3      LYS  20   5.696  -4.483   4.666
  168    H    LYS  21           H        LYS  21   7.946  -2.914  -1.011
  169    HA   LYS  21           HA       LYS  21  10.058  -3.741  -2.626
  170    HB2  LYS  21           HB2      LYS  21   7.709  -1.931  -3.048
  171    HB3  LYS  21           HB3      LYS  21   8.933  -2.066  -4.304
  172    HG2  LYS  21           HG2      LYS  21   7.670  -4.516  -3.145
  173    HG3  LYS  21           HG3      LYS  21   6.854  -3.586  -4.404
  174    HD2  LYS  21           HD2      LYS  21   8.648  -3.934  -5.932
  175    HD3  LYS  21           HD3      LYS  21   9.678  -4.606  -4.666
  176    HE2  LYS  21           HE2      LYS  21   8.959  -6.523  -5.704
  177    HE3  LYS  21           HE3      LYS  21   7.740  -6.353  -4.442
  178    HZ1  LYS  21           HZ1      LYS  21   6.695  -4.922  -6.478
  179    HZ2  LYS  21           HZ2      LYS  21   6.294  -6.524  -6.114
  180    HZ3  LYS  21           HZ3      LYS  21   7.454  -6.191  -7.300
  181    H    TYR  22           H        TYR  22   9.394  -0.612  -1.165
  182    HA   TYR  22           HA       TYR  22  11.353   0.856  -2.583
  183    HB2  TYR  22           HB2      TYR  22   9.826   1.289  -0.042
  184    HB3  TYR  22           HB3      TYR  22  11.161   2.361  -0.447
  185    HD1  TYR  22           HD1      TYR  22   8.514   0.792  -2.565
  186    HD2  TYR  22           HD2      TYR  22  10.271   4.388  -1.120
  187    HE1  TYR  22           HE1      TYR  22   7.016   2.099  -4.014
  188    HE2  TYR  22           HE2      TYR  22   8.777   5.704  -2.564
  189    HH   TYR  22           HH       TYR  22   6.946   5.625  -3.879
  190    H    LEU  23           H        LEU  23  11.396  -0.737   0.590
  191    HA   LEU  23           HA       LEU  23  14.006  -0.005   1.312
  192    HB2  LEU  23           HB2      LEU  23  12.702  -2.593   2.097
  193    HB3  LEU  23           HB3      LEU  23  13.860  -1.630   3.013
  194    HG   LEU  23           HG       LEU  23  10.930  -1.120   2.579
  195   HD11  LEU  23          HD11      LEU  23  12.686  -1.897   4.819
  196   HD12  LEU  23          HD12      LEU  23  10.999  -2.301   4.500
  197   HD13  LEU  23          HD13      LEU  23  11.415  -0.731   5.188
  198   HD21  LEU  23          HD21      LEU  23  13.079   0.818   2.913
  199   HD22  LEU  23          HD22      LEU  23  11.841   0.933   4.164
  200   HD23  LEU  23          HD23      LEU  23  11.392   1.062   2.462
  201    H    ASN  24           H        ASN  24  12.773  -2.617  -0.672
  202    HA   ASN  24           HA       ASN  24  15.103  -4.193  -0.771
  203    HB2  ASN  24           HB2      ASN  24  12.757  -4.818  -1.553
  204    HB3  ASN  24           HB3      ASN  24  13.112  -3.914  -3.022
  205   HD21  ASN  24          HD21      ASN  24  14.692  -4.683  -4.440
  206   HD22  ASN  24          HD22      ASN  24  15.230  -6.325  -4.395
  207    H    SER  25           H        SER  25  13.985  -1.503  -2.781
  208    HA   SER  25           HA       SER  25  16.129  -1.641  -4.640
  209    HB2  SER  25           HB2      SER  25  14.165  -0.528  -5.374
  210    HB3  SER  25           HB3      SER  25  14.134   0.516  -3.953
  211    HG   SER  25           HG       SER  25  16.343   0.589  -5.686
  212    H    ILE  26           H        ILE  26  15.480   0.537  -1.898
  213    HA   ILE  26           HA       ILE  26  17.888   1.974  -2.064
  214    HB   ILE  26           HB       ILE  26  15.975   1.495   0.206
  215   HG12  ILE  26          HG12      ILE  26  15.176   3.636  -0.249
  216   HG13  ILE  26          HG13      ILE  26  16.670   4.135  -1.034
  217   HG21  ILE  26          HG21      ILE  26  18.659   2.772   0.257
  218   HG22  ILE  26          HG22      ILE  26  17.363   3.506   1.200
  219   HG23  ILE  26          HG23      ILE  26  17.830   1.832   1.498
  220   HD11  ILE  26          HD11      ILE  26  14.910   3.924  -2.660
  221   HD12  ILE  26          HD12      ILE  26  16.124   2.674  -2.935
  222   HD13  ILE  26          HD13      ILE  26  14.597   2.264  -2.152
  223    H    LEU  27           H        LEU  27  16.990  -0.720   0.092
  224    HA   LEU  27           HA       LEU  27  19.503  -0.985   1.313
  225    HB2  LEU  27           HB2      LEU  27  17.410  -3.105   0.850
  226    HB3  LEU  27           HB3      LEU  27  18.737  -3.198   2.007
  227    HG   LEU  27           HG       LEU  27  16.649  -1.046   2.179
  228   HD11  LEU  27          HD11      LEU  27  15.532  -2.496   3.868
  229   HD12  LEU  27          HD12      LEU  27  16.540  -3.833   3.315
  230   HD13  LEU  27          HD13      LEU  27  15.392  -3.079   2.209
  231   HD21  LEU  27          HD21      LEU  27  18.486  -0.543   3.536
  232   HD22  LEU  27          HD22      LEU  27  18.704  -2.225   4.022
  233   HD23  LEU  27          HD23      LEU  27  17.330  -1.301   4.631
  234    H    ASN  28           H        ASN  28  18.154  -2.412  -1.611
  235    HA   ASN  28           HA       ASN  28  20.058  -4.358  -2.136
  236    HB2  ASN  28           HB2      ASN  28  18.196  -4.382  -3.551
  237    HB3  ASN  28           HB3      ASN  28  18.327  -2.663  -3.910
  238   HD21  ASN  28          HD21      ASN  28  19.958  -5.759  -4.371
  239   HD22  ASN  28          HD22      ASN  28  20.643  -5.370  -5.909
  240    H    GLY  29           H        GLY  29  20.191  -0.885  -2.643
  241    HA2  GLY  29           HA2      GLY  29  22.843  -1.149  -3.879
  242    HA3  GLY  29           HA3      GLY  29  21.849   0.300  -3.883
  Start of MODEL    7
    1    H1   HIS   1           H        HIS   1 -24.037   3.687  -2.048
    2    HA   HIS   1           HA       HIS   1 -23.005   2.590   0.442
    3    HB2  HIS   1           HB2      HIS   1 -21.732   0.828  -0.914
    4    HB3  HIS   1           HB3      HIS   1 -23.443   0.532  -0.622
    5    HD1  HIS   1           HD1      HIS   1 -25.047   0.748  -2.666
    6    HD2  HIS   1           HD2      HIS   1 -21.017   1.185  -3.576
    7    HE1  HIS   1           HE1      HIS   1 -24.899   0.561  -5.169
    8    HE2  HIS   1           HE2      HIS   1 -22.442   0.744  -5.690
    9    H    SER   2           H        SER   2 -21.199   3.627   0.945
   10    HA   SER   2           HA       SER   2 -19.904   5.318  -1.001
   11    HB2  SER   2           HB2      SER   2 -19.706   4.914   1.951
   12    HB3  SER   2           HB3      SER   2 -18.342   5.659   1.118
   13    HG   SER   2           HG       SER   2 -20.090   7.062   0.166
   14    H    ASP   3           H        ASP   3 -17.954   5.033  -1.948
   15    HA   ASP   3           HA       ASP   3 -16.715   2.400  -1.632
   16    HB2  ASP   3           HB2      ASP   3 -17.170   2.825  -3.902
   17    HB3  ASP   3           HB3      ASP   3 -16.615   4.493  -3.792
   18    H    ALA   4           H        ALA   4 -16.256   5.642  -0.748
   19    HA   ALA   4           HA       ALA   4 -13.545   6.066  -0.814
   20    HB1  ALA   4           HB1      ALA   4 -15.777   7.070   0.746
   21    HB2  ALA   4           HB2      ALA   4 -14.263   7.081   1.651
   22    HB3  ALA   4           HB3      ALA   4 -14.372   7.921   0.103
   23    H    VAL   5           H        VAL   5 -15.363   4.434   1.780
   24    HA   VAL   5           HA       VAL   5 -13.138   3.794   3.371
   25    HB   VAL   5           HB       VAL   5 -15.297   3.661   4.366
   26   HG11  VAL   5          HG11      VAL   5 -16.329   1.300   3.032
   27   HG12  VAL   5          HG12      VAL   5 -17.116   2.844   3.367
   28   HG13  VAL   5          HG13      VAL   5 -16.119   2.655   1.924
   29   HG21  VAL   5          HG21      VAL   5 -15.336   1.275   5.181
   30   HG22  VAL   5          HG22      VAL   5 -14.024   0.950   4.048
   31   HG23  VAL   5          HG23      VAL   5 -13.794   2.113   5.354
   32    H    PHE   6           H        PHE   6 -14.712   2.069   0.727
   33    HA   PHE   6           HA       PHE   6 -13.380  -0.381   0.984
   34    HB2  PHE   6           HB2      PHE   6 -14.751   1.039  -1.262
   35    HB3  PHE   6           HB3      PHE   6 -13.797  -0.396  -1.624
   36    HD1  PHE   6           HD1      PHE   6 -16.370   0.714   0.842
   37    HD2  PHE   6           HD2      PHE   6 -14.905  -2.399  -1.663
   38    HE1  PHE   6           HE1      PHE   6 -18.268  -0.706   1.502
   39    HE2  PHE   6           HE2      PHE   6 -16.801  -3.824  -1.007
   40    HZ   PHE   6           HZ       PHE   6 -18.486  -2.977   0.576
   41    H    THR   7           H        THR   7 -12.612   2.372  -1.147
   42    HA   THR   7           HA       THR   7 -10.167   1.281  -2.072
   43    HB   THR   7           HB       THR   7 -11.409   3.040  -3.295
   44    HG1  THR   7           HG1      THR   7  -8.715   3.552  -2.542
   45   HG21  THR   7          HG21      THR   7 -10.387   4.869  -1.118
   46   HG22  THR   7          HG22      THR   7 -12.071   4.405  -1.364
   47   HG23  THR   7          HG23      THR   7 -11.235   5.369  -2.581
   48    H    ASP   8           H        ASP   8 -10.995   3.473   0.563
   49    HA   ASP   8           HA       ASP   8  -8.453   4.349   1.268
   50    HB2  ASP   8           HB2      ASP   8 -11.038   4.022   2.703
   51    HB3  ASP   8           HB3      ASP   8  -9.595   4.259   3.685
   52    H    ASN   9           H        ASN   9 -10.194   1.437   2.312
   53    HA   ASN   9           HA       ASN   9  -8.267   0.495   4.118
   54    HB2  ASN   9           HB2      ASN   9 -10.523  -0.738   2.601
   55    HB3  ASN   9           HB3      ASN   9  -9.357  -1.809   3.373
   56   HD21  ASN   9          HD21      ASN   9  -9.641  -2.274   5.439
   57   HD22  ASN   9          HD22      ASN   9 -10.699  -1.442   6.523
   58    H    TYR  10           H        TYR  10  -8.625   0.041   0.638
   59    HA   TYR  10           HA       TYR  10  -6.508  -1.858   0.405
   60    HB2  TYR  10           HB2      TYR  10  -7.632  -0.087  -1.771
   61    HB3  TYR  10           HB3      TYR  10  -6.776  -1.611  -1.975
   62    HD1  TYR  10           HD1      TYR  10  -8.137  -3.232   0.140
   63    HD2  TYR  10           HD2      TYR  10  -9.708  -0.547  -2.763
   64    HE1  TYR  10           HE1      TYR  10 -10.277  -4.443   0.186
   65    HE2  TYR  10           HE2      TYR  10 -11.853  -1.750  -2.725
   66    HH   TYR  10           HH       TYR  10 -12.767  -3.803  -0.361
   67    H    THR  11           H        THR  11  -6.754   1.639   0.119
   68    HA   THR  11           HA       THR  11  -4.212   2.124  -0.988
   69    HB   THR  11           HB       THR  11  -5.797   3.938   0.841
   70    HG1  THR  11           HG1      THR  11  -6.756   3.084  -1.251
   71   HG21  THR  11          HG21      THR  11  -4.307   5.564   0.422
   72   HG22  THR  11          HG22      THR  11  -4.167   5.118  -1.279
   73   HG23  THR  11          HG23      THR  11  -3.224   4.260  -0.061
   74    H    ARG  12           H        ARG  12  -5.322   2.080   2.389
   75    HA   ARG  12           HA       ARG  12  -2.876   2.766   3.572
   76    HB2  ARG  12           HB2      ARG  12  -3.809   1.765   5.629
   77    HB3  ARG  12           HB3      ARG  12  -4.953   2.831   4.824
   78    HG2  ARG  12           HG2      ARG  12  -6.188   0.975   3.968
   79    HG3  ARG  12           HG3      ARG  12  -4.962  -0.162   4.532
   80    HD2  ARG  12           HD2      ARG  12  -6.454  -0.370   6.239
   81    HD3  ARG  12           HD3      ARG  12  -5.511   0.985   6.858
   82    HE   ARG  12           HE       ARG  12  -7.491   2.173   5.427
   83   HH11  ARG  12          HH12      ARG  12  -7.426  -0.175   7.998
   84   HH12  ARG  12          HH11      ARG  12  -8.950   0.314   8.660
   85   HH21  ARG  12          HH22      ARG  12  -9.500   2.826   6.289
   86   HH22  ARG  12          HH21      ARG  12 -10.130   2.021   7.687
   87    H    LEU  13           H        LEU  13  -4.262  -0.402   2.785
   88    HA   LEU  13           HA       LEU  13  -2.148  -1.930   3.882
   89    HB2  LEU  13           HB2      LEU  13  -4.327  -2.894   3.454
   90    HB3  LEU  13           HB3      LEU  13  -4.147  -2.598   1.727
   91    HG   LEU  13           HG       LEU  13  -2.096  -4.176   1.923
   92   HD11  LEU  13          HD11      LEU  13  -3.359  -4.419   4.566
   93   HD12  LEU  13          HD12      LEU  13  -1.703  -4.748   4.060
   94   HD13  LEU  13          HD13      LEU  13  -2.967  -5.943   3.769
   95   HD21  LEU  13          HD21      LEU  13  -4.947  -5.139   2.109
   96   HD22  LEU  13          HD22      LEU  13  -3.582  -6.138   1.610
   97   HD23  LEU  13          HD23      LEU  13  -4.052  -4.739   0.643
   98    H    ARG  14           H        ARG  14  -2.721  -0.537   0.703
   99    HA   ARG  14           HA       ARG  14  -0.712  -1.857  -0.725
  100    HB2  ARG  14           HB2      ARG  14  -2.595  -0.208  -1.502
  101    HB3  ARG  14           HB3      ARG  14  -1.354   1.017  -1.267
  102    HG2  ARG  14           HG2      ARG  14  -1.306   0.404  -3.551
  103    HG3  ARG  14           HG3      ARG  14   0.118  -0.316  -2.797
  104    HD2  ARG  14           HD2      ARG  14  -0.632  -2.117  -3.978
  105    HD3  ARG  14           HD3      ARG  14  -1.528  -2.359  -2.479
  106    HE   ARG  14           HE       ARG  14  -3.194  -0.840  -3.996
  107   HH11  ARG  14          HH12      ARG  14  -1.527  -3.856  -4.492
  108   HH12  ARG  14          HH11      ARG  14  -2.734  -4.498  -5.557
  109   HH21  ARG  14          HH22      ARG  14  -4.790  -1.675  -5.396
  110   HH22  ARG  14          HH21      ARG  14  -4.589  -3.256  -6.071
  111    H    LYS  15           H        LYS  15  -0.591   0.976   1.357
  112    HA   LYS  15           HA       LYS  15   1.990   1.862   0.718
  113    HB2  LYS  15           HB2      LYS  15   0.548   3.284   1.992
  114    HB3  LYS  15           HB3      LYS  15   0.373   2.075   3.257
  115    HG2  LYS  15           HG2      LYS  15   1.880   3.438   4.261
  116    HG3  LYS  15           HG3      LYS  15   2.997   2.374   3.403
  117    HD2  LYS  15           HD2      LYS  15   2.000   4.790   1.985
  118    HD3  LYS  15           HD3      LYS  15   3.192   5.015   3.267
  119    HE2  LYS  15           HE2      LYS  15   4.793   3.709   2.155
  120    HE3  LYS  15           HE3      LYS  15   3.592   3.004   1.074
  121    HZ1  LYS  15           HZ1      LYS  15   3.719   4.731  -0.322
  122    HZ2  LYS  15           HZ2      LYS  15   5.205   5.043   0.424
  123    HZ3  LYS  15           HZ3      LYS  15   3.820   5.881   0.915
  124    H    GLN  16           H        GLN  16   0.877  -0.431   3.189
  125    HA   GLN  16           HA       GLN  16   3.368  -0.926   4.371
  126    HB2  GLN  16           HB2      GLN  16   0.796  -2.446   4.205
  127    HB3  GLN  16           HB3      GLN  16   2.216  -3.226   4.887
  128    HG2  GLN  16           HG2      GLN  16   0.735  -2.193   6.573
  129    HG3  GLN  16           HG3      GLN  16   2.385  -1.574   6.602
  130   HE21  GLN  16          HE21      GLN  16   2.791   0.505   5.706
  131   HE22  GLN  16          HE22      GLN  16   1.531   1.684   5.621
  132    H    MET  17           H        MET  17   1.700  -2.598   1.720
  133    HA   MET  17           HA       MET  17   3.749  -4.524   1.313
  134    HB2  MET  17           HB2      MET  17   1.624  -3.573  -0.616
  135    HB3  MET  17           HB3      MET  17   2.574  -5.045  -0.769
  136    HG2  MET  17           HG2      MET  17   0.939  -4.616   1.682
  137    HG3  MET  17           HG3      MET  17   0.148  -5.110   0.187
  138    HE1  MET  17           HE1      MET  17   0.953  -8.427  -0.606
  139    HE2  MET  17           HE2      MET  17   1.034  -6.795  -1.271
  140    HE3  MET  17           HE3      MET  17   2.519  -7.690  -0.944
  141    H    ALA  18           H        ALA  18   3.074  -1.346  -0.032
  142    HA   ALA  18           HA       ALA  18   5.056  -1.488  -2.084
  143    HB1  ALA  18           HB1      ALA  18   4.411   0.631  -2.668
  144    HB2  ALA  18           HB2      ALA  18   2.966   0.081  -1.820
  145    HB3  ALA  18           HB3      ALA  18   4.126   1.125  -0.999
  146    H    VAL  19           H        VAL  19   5.049  -0.586   1.276
  147    HA   VAL  19           HA       VAL  19   7.387   0.967   1.355
  148    HB   VAL  19           HB       VAL  19   5.823  -0.574   3.359
  149   HG11  VAL  19          HG11      VAL  19   7.594   0.154   5.076
  150   HG12  VAL  19          HG12      VAL  19   7.903  -1.300   4.124
  151   HG13  VAL  19          HG13      VAL  19   8.694   0.218   3.699
  152   HG21  VAL  19          HG21      VAL  19   6.857   2.251   3.170
  153   HG22  VAL  19          HG22      VAL  19   5.202   1.702   2.906
  154   HG23  VAL  19          HG23      VAL  19   5.910   1.625   4.519
  155    H    LYS  20           H        LYS  20   6.906  -2.523   1.826
  156    HA   LYS  20           HA       LYS  20   9.538  -3.220   2.408
  157    HB2  LYS  20           HB2      LYS  20   7.167  -4.648   1.325
  158    HB3  LYS  20           HB3      LYS  20   8.730  -5.431   1.130
  159    HG2  LYS  20           HG2      LYS  20   7.606  -6.191   3.145
  160    HG3  LYS  20           HG3      LYS  20   9.096  -5.329   3.536
  161    HD2  LYS  20           HD2      LYS  20   7.694  -4.342   5.042
  162    HD3  LYS  20           HD3      LYS  20   7.428  -3.270   3.665
  163    HE2  LYS  20           HE2      LYS  20   5.301  -3.873   4.617
  164    HE3  LYS  20           HE3      LYS  20   5.462  -4.639   3.037
  165    HZ1  LYS  20           HZ1      LYS  20   6.246  -6.118   5.456
  166    HZ2  LYS  20           HZ2      LYS  20   5.706  -6.711   3.967
  167    HZ3  LYS  20           HZ3      LYS  20   4.609  -6.005   5.043
  168    H    LYS  21           H        LYS  21   7.933  -2.775  -0.702
  169    HA   LYS  21           HA       LYS  21  10.040  -3.738  -2.318
  170    HB2  LYS  21           HB2      LYS  21   7.840  -1.757  -2.929
  171    HB3  LYS  21           HB3      LYS  21   8.913  -2.452  -4.137
  172    HG2  LYS  21           HG2      LYS  21   7.408  -4.310  -2.379
  173    HG3  LYS  21           HG3      LYS  21   6.525  -3.458  -3.647
  174    HD2  LYS  21           HD2      LYS  21   7.749  -4.460  -5.348
  175    HD3  LYS  21           HD3      LYS  21   9.090  -4.869  -4.275
  176    HE2  LYS  21           HE2      LYS  21   7.834  -6.611  -3.245
  177    HE3  LYS  21           HE3      LYS  21   6.348  -6.092  -4.039
  178    HZ1  LYS  21           HZ1      LYS  21   7.429  -8.072  -5.050
  179    HZ2  LYS  21           HZ2      LYS  21   8.728  -7.088  -5.503
  180    HZ3  LYS  21           HZ3      LYS  21   7.185  -6.796  -6.132
  181    H    TYR  22           H        TYR  22   9.323  -0.580  -0.950
  182    HA   TYR  22           HA       TYR  22  11.251   0.878  -2.423
  183    HB2  TYR  22           HB2      TYR  22   9.743   1.373   0.123
  184    HB3  TYR  22           HB3      TYR  22  11.028   2.470  -0.370
  185    HD1  TYR  22           HD1      TYR  22   8.494   0.701  -2.454
  186    HD2  TYR  22           HD2      TYR  22   9.942   4.430  -1.002
  187    HE1  TYR  22           HE1      TYR  22   6.915   1.880  -3.926
  188    HE2  TYR  22           HE2      TYR  22   8.366   5.619  -2.469
  189    HH   TYR  22           HH       TYR  22   5.765   4.237  -3.879
  190    H    LEU  23           H        LEU  23  11.363  -0.899   0.610
  191    HA   LEU  23           HA       LEU  23  13.944   0.001   1.396
  192    HB2  LEU  23           HB2      LEU  23  12.674  -2.605   2.189
  193    HB3  LEU  23           HB3      LEU  23  13.843  -1.644   3.093
  194    HG   LEU  23           HG       LEU  23  10.896  -1.277   2.806
  195   HD11  LEU  23          HD11      LEU  23  12.895  -1.616   4.946
  196   HD12  LEU  23          HD12      LEU  23  11.228  -2.182   4.844
  197   HD13  LEU  23          HD13      LEU  23  11.565  -0.509   5.290
  198   HD21  LEU  23          HD21      LEU  23  11.553   1.036   3.980
  199   HD22  LEU  23          HD22      LEU  23  11.280   0.883   2.244
  200   HD23  LEU  23          HD23      LEU  23  12.925   0.874   2.883
  201    H    ASN  24           H        ASN  24  12.765  -2.646  -0.575
  202    HA   ASN  24           HA       ASN  24  15.238  -4.060  -0.694
  203    HB2  ASN  24           HB2      ASN  24  14.140  -5.560  -2.039
  204    HB3  ASN  24           HB3      ASN  24  12.748  -4.788  -1.285
  205   HD21  ASN  24          HD21      ASN  24  14.914  -4.341  -4.059
  206   HD22  ASN  24          HD22      ASN  24  13.672  -3.887  -5.172
  207    H    SER  25           H        SER  25  13.589  -1.813  -2.899
  208    HA   SER  25           HA       SER  25  15.643  -1.848  -4.863
  209    HB2  SER  25           HB2      SER  25  13.275  -1.179  -5.306
  210    HB3  SER  25           HB3      SER  25  13.564   0.301  -4.391
  211    HG   SER  25           HG       SER  25  15.058  -0.488  -6.671
  212    H    ILE  26           H        ILE  26  15.167  -0.109  -1.910
  213    HA   ILE  26           HA       ILE  26  17.133   1.925  -2.545
  214    HB   ILE  26           HB       ILE  26  15.609   1.337  -0.007
  215   HG12  ILE  26          HG12      ILE  26  15.385   3.802  -1.709
  216   HG13  ILE  26          HG13      ILE  26  14.501   2.342  -2.139
  217   HG21  ILE  26          HG21      ILE  26  18.029   2.769  -0.317
  218   HG22  ILE  26          HG22      ILE  26  16.749   3.945  -0.026
  219   HG23  ILE  26          HG23      ILE  26  17.015   2.631   1.119
  220   HD11  ILE  26          HD11      ILE  26  12.917   3.343  -0.883
  221   HD12  ILE  26          HD12      ILE  26  13.781   2.520   0.416
  222   HD13  ILE  26          HD13      ILE  26  14.089   4.227   0.094
  223    H    LEU  27           H        LEU  27  16.827  -0.624  -0.066
  224    HA   LEU  27           HA       LEU  27  19.451  -0.409   0.904
  225    HB2  LEU  27           HB2      LEU  27  17.543  -2.741   0.904
  226    HB3  LEU  27           HB3      LEU  27  19.063  -2.709   1.795
  227    HG   LEU  27           HG       LEU  27  16.953  -0.632   2.272
  228   HD11  LEU  27          HD11      LEU  27  15.840  -1.948   3.829
  229   HD12  LEU  27          HD12      LEU  27  17.135  -3.143   3.893
  230   HD13  LEU  27          HD13      LEU  27  16.091  -3.050   2.474
  231   HD21  LEU  27          HD21      LEU  27  18.168  -0.075   4.097
  232   HD22  LEU  27          HD22      LEU  27  19.481  -0.763   3.140
  233   HD23  LEU  27          HD23      LEU  27  18.698  -1.732   4.389
  234    H    ASN  28           H        ASN  28  18.053  -2.461  -1.619
  235    HA   ASN  28           HA       ASN  28  20.753  -3.402  -2.298
  236    HB2  ASN  28           HB2      ASN  28  18.029  -4.563  -2.584
  237    HB3  ASN  28           HB3      ASN  28  19.203  -4.949  -3.839
  238   HD21  ASN  28          HD21      ASN  28  18.019  -5.785  -0.842
  239   HD22  ASN  28          HD22      ASN  28  19.294  -6.835  -0.334
  240    H    GLY  29           H        GLY  29  19.506  -0.765  -2.987
  241    HA2  GLY  29           HA2      GLY  29  18.980  -0.848  -5.812
  242    HA3  GLY  29           HA3      GLY  29  19.162   0.595  -4.825
  Start of MODEL    8
    1    H1   HIS   1           H        HIS   1 -20.343  -3.910  -5.089
    2    HA   HIS   1           HA       HIS   1 -20.638  -1.441  -4.020
    3    HB2  HIS   1           HB2      HIS   1 -20.313  -4.105  -2.659
    4    HB3  HIS   1           HB3      HIS   1 -20.627  -2.639  -1.735
    5    HD1  HIS   1           HD1      HIS   1 -22.922  -3.655  -1.004
    6    HD2  HIS   1           HD2      HIS   1 -22.534  -2.996  -5.088
    7    HE1  HIS   1           HE1      HIS   1 -25.252  -3.822  -1.936
    8    HE2  HIS   1           HE2      HIS   1 -24.981  -3.504  -4.420
    9    H    SER   2           H        SER   2 -18.826  -0.134  -4.326
   10    HA   SER   2           HA       SER   2 -16.670  -0.585  -2.377
   11    HB2  SER   2           HB2      SER   2 -16.284   0.464  -5.191
   12    HB3  SER   2           HB3      SER   2 -15.021   0.244  -3.979
   13    HG   SER   2           HG       SER   2 -14.963  -1.808  -4.433
   14    H    ASP   3           H        ASP   3 -16.794   0.986  -0.927
   15    HA   ASP   3           HA       ASP   3 -17.597   3.676  -1.818
   16    HB2  ASP   3           HB2      ASP   3 -17.904   2.253   0.819
   17    HB3  ASP   3           HB3      ASP   3 -18.035   4.005   0.697
   18    H    ALA   4           H        ALA   4 -16.710   5.349  -0.044
   19    HA   ALA   4           HA       ALA   4 -14.012   5.703  -0.554
   20    HB1  ALA   4           HB1      ALA   4 -15.980   7.165   0.680
   21    HB2  ALA   4           HB2      ALA   4 -14.840   6.858   1.991
   22    HB3  ALA   4           HB3      ALA   4 -14.291   7.646   0.512
   23    H    VAL   5           H        VAL   5 -15.562   4.251   2.286
   24    HA   VAL   5           HA       VAL   5 -13.249   3.857   3.819
   25    HB   VAL   5           HB       VAL   5 -15.444   3.623   4.813
   26   HG11  VAL   5          HG11      VAL   5 -17.084   2.214   4.119
   27   HG12  VAL   5          HG12      VAL   5 -16.238   2.398   2.582
   28   HG13  VAL   5          HG13      VAL   5 -15.948   0.976   3.585
   29   HG21  VAL   5          HG21      VAL   5 -15.129   1.279   5.840
   30   HG22  VAL   5          HG22      VAL   5 -13.664   1.212   4.862
   31   HG23  VAL   5          HG23      VAL   5 -13.857   2.478   6.074
   32    H    PHE   6           H        PHE   6 -14.818   1.790   1.410
   33    HA   PHE   6           HA       PHE   6 -13.197  -0.472   1.740
   34    HB2  PHE   6           HB2      PHE   6 -14.845   0.580  -0.539
   35    HB3  PHE   6           HB3      PHE   6 -13.850  -0.857  -0.750
   36    HD1  PHE   6           HD1      PHE   6 -16.775   0.560   0.926
   37    HD2  PHE   6           HD2      PHE   6 -14.402  -2.927   0.354
   38    HE1  PHE   6           HE1      PHE   6 -18.560  -0.813   1.916
   39    HE2  PHE   6           HE2      PHE   6 -16.184  -4.306   1.341
   40    HZ   PHE   6           HZ       PHE   6 -18.267  -3.250   2.123
   41    H    THR   7           H        THR   7 -12.946   2.144  -0.668
   42    HA   THR   7           HA       THR   7 -10.520   1.258  -1.793
   43    HB   THR   7           HB       THR   7 -11.999   2.845  -2.946
   44    HG1  THR   7           HG1      THR   7 -10.327   3.819  -3.902
   45   HG21  THR   7          HG21      THR   7 -11.082   4.786  -0.821
   46   HG22  THR   7          HG22      THR   7 -12.726   4.199  -1.073
   47   HG23  THR   7          HG23      THR   7 -11.962   5.231  -2.282
   48    H    ASP   8           H        ASP   8 -11.238   3.472   0.857
   49    HA   ASP   8           HA       ASP   8  -8.704   4.560   1.244
   50    HB2  ASP   8           HB2      ASP   8 -10.265   5.625   2.546
   51    HB3  ASP   8           HB3      ASP   8 -11.095   4.128   2.964
   52    H    ASN   9           H        ASN   9 -10.045   1.479   2.271
   53    HA   ASN   9           HA       ASN   9  -7.887   0.785   3.999
   54    HB2  ASN   9           HB2      ASN   9 -10.210  -0.671   2.801
   55    HB3  ASN   9           HB3      ASN   9  -8.901  -1.605   3.520
   56   HD21  ASN   9          HD21      ASN   9  -8.289  -0.979   5.749
   57   HD22  ASN   9          HD22      ASN   9  -9.555  -0.518   6.831
   58    H    TYR  10           H        TYR  10  -8.694   0.033   0.634
   59    HA   TYR  10           HA       TYR  10  -6.600  -1.764   0.138
   60    HB2  TYR  10           HB2      TYR  10  -7.940   0.130  -1.805
   61    HB3  TYR  10           HB3      TYR  10  -6.992  -1.289  -2.238
   62    HD1  TYR  10           HD1      TYR  10  -8.070  -3.140  -0.079
   63    HD2  TYR  10           HD2      TYR  10 -10.011  -0.484  -2.778
   64    HE1  TYR  10           HE1      TYR  10 -10.098  -4.529   0.022
   65    HE2  TYR  10           HE2      TYR  10 -12.044  -1.864  -2.683
   66    HH   TYR  10           HH       TYR  10 -12.527  -4.270  -0.357
   67    H    THR  11           H        THR  11  -6.773   1.755  -0.191
   68    HA   THR  11           HA       THR  11  -4.229   2.115  -1.350
   69    HB   THR  11           HB       THR  11  -5.837   3.905  -1.460
   70    HG1  THR  11           HG1      THR  11  -4.442   5.544  -0.971
   71   HG21  THR  11          HG21      THR  11  -7.080   3.562   0.567
   72   HG22  THR  11          HG22      THR  11  -6.421   5.198   0.599
   73   HG23  THR  11          HG23      THR  11  -5.664   3.922   1.553
   74    H    ARG  12           H        ARG  12  -5.322   2.065   2.012
   75    HA   ARG  12           HA       ARG  12  -2.849   2.826   3.158
   76    HB2  ARG  12           HB2      ARG  12  -5.184   2.798   4.235
   77    HB3  ARG  12           HB3      ARG  12  -4.891   1.089   4.524
   78    HG2  ARG  12           HG2      ARG  12  -2.991   1.583   5.898
   79    HG3  ARG  12           HG3      ARG  12  -3.094   3.298   5.493
   80    HD2  ARG  12           HD2      ARG  12  -5.481   1.991   6.690
   81    HD3  ARG  12           HD3      ARG  12  -4.104   2.325   7.739
   82    HE   ARG  12           HE       ARG  12  -4.930   4.575   6.149
   83   HH11  ARG  12          HH12      ARG  12  -5.416   2.826   9.119
   84   HH12  ARG  12          HH11      ARG  12  -6.072   4.188   9.966
   85   HH21  ARG  12          HH22      ARG  12  -5.791   6.375   7.253
   86   HH22  ARG  12          HH21      ARG  12  -6.285   6.206   8.904
   87    H    LEU  13           H        LEU  13  -4.312  -0.322   2.462
   88    HA   LEU  13           HA       LEU  13  -2.267  -1.878   3.648
   89    HB2  LEU  13           HB2      LEU  13  -4.458  -2.798   3.208
   90    HB3  LEU  13           HB3      LEU  13  -4.248  -2.544   1.477
   91    HG   LEU  13           HG       LEU  13  -2.182  -4.162   1.868
   92   HD11  LEU  13          HD11      LEU  13  -4.111  -4.900   4.062
   93   HD12  LEU  13          HD12      LEU  13  -2.443  -4.366   4.258
   94   HD13  LEU  13          HD13      LEU  13  -2.788  -5.916   3.491
   95   HD21  LEU  13          HD21      LEU  13  -4.805  -5.547   1.832
   96   HD22  LEU  13          HD22      LEU  13  -3.405  -5.739   0.776
   97   HD23  LEU  13          HD23      LEU  13  -4.486  -4.361   0.566
   98    H    ARG  14           H        ARG  14  -2.756  -0.607   0.397
   99    HA   ARG  14           HA       ARG  14  -0.730  -2.015  -0.921
  100    HB2  ARG  14           HB2      ARG  14  -2.582  -0.382  -1.813
  101    HB3  ARG  14           HB3      ARG  14  -1.326   0.833  -1.623
  102    HG2  ARG  14           HG2      ARG  14  -1.306   0.059  -3.881
  103    HG3  ARG  14           HG3      ARG  14   0.146  -0.537  -3.075
  104    HD2  ARG  14           HD2      ARG  14  -0.928  -2.248  -4.488
  105    HD3  ARG  14           HD3      ARG  14  -0.859  -2.714  -2.790
  106    HE   ARG  14           HE       ARG  14  -3.323  -1.450  -3.623
  107   HH11  ARG  14          HH12      ARG  14  -1.592  -4.433  -3.151
  108   HH12  ARG  14          HH11      ARG  14  -3.027  -5.399  -3.035
  109   HH21  ARG  14          HH22      ARG  14  -5.219  -2.710  -3.471
  110   HH22  ARG  14          HH21      ARG  14  -5.089  -4.417  -3.218
  111    H    LYS  15           H        LYS  15  -0.627   0.918   1.020
  112    HA   LYS  15           HA       LYS  15   1.970   1.758   0.394
  113    HB2  LYS  15           HB2      LYS  15   0.331   3.126   1.637
  114    HB3  LYS  15           HB3      LYS  15   0.496   2.050   3.019
  115    HG2  LYS  15           HG2      LYS  15   1.883   3.777   3.611
  116    HG3  LYS  15           HG3      LYS  15   3.021   2.664   2.847
  117    HD2  LYS  15           HD2      LYS  15   2.340   4.047   0.688
  118    HD3  LYS  15           HD3      LYS  15   1.983   5.284   1.896
  119    HE2  LYS  15           HE2      LYS  15   4.336   4.709   2.817
  120    HE3  LYS  15           HE3      LYS  15   4.598   3.982   1.232
  121    HZ1  LYS  15           HZ1      LYS  15   4.941   5.976   0.368
  122    HZ2  LYS  15           HZ2      LYS  15   4.840   6.652   1.915
  123    HZ3  LYS  15           HZ3      LYS  15   3.458   6.552   0.944
  124    H    GLN  16           H        GLN  16   0.805  -0.425   2.939
  125    HA   GLN  16           HA       GLN  16   3.266  -0.883   4.190
  126    HB2  GLN  16           HB2      GLN  16   0.674  -2.349   4.042
  127    HB3  GLN  16           HB3      GLN  16   2.069  -3.195   4.698
  128    HG2  GLN  16           HG2      GLN  16   1.085  -0.537   5.704
  129    HG3  GLN  16           HG3      GLN  16   0.629  -2.092   6.397
  130   HE21  GLN  16          HE21      GLN  16   2.751   0.445   6.584
  131   HE22  GLN  16          HE22      GLN  16   3.994  -0.301   7.523
  132    H    MET  17           H        MET  17   1.664  -2.648   1.557
  133    HA   MET  17           HA       MET  17   3.724  -4.583   1.267
  134    HB2  MET  17           HB2      MET  17   1.583  -3.695  -0.673
  135    HB3  MET  17           HB3      MET  17   2.607  -5.108  -0.886
  136    HG2  MET  17           HG2      MET  17   1.015  -4.862   1.612
  137    HG3  MET  17           HG3      MET  17   0.194  -5.306   0.117
  138    HE1  MET  17           HE1      MET  17   0.441  -8.799  -0.113
  139    HE2  MET  17           HE2      MET  17  -0.339  -8.162   1.334
  140    HE3  MET  17           HE3      MET  17  -0.442  -7.273  -0.186
  141    H    ALA  18           H        ALA  18   3.077  -1.456  -0.205
  142    HA   ALA  18           HA       ALA  18   5.108  -1.664  -2.202
  143    HB1  ALA  18           HB1      ALA  18   4.207   1.002  -1.266
  144    HB2  ALA  18           HB2      ALA  18   4.426   0.389  -2.905
  145    HB3  ALA  18           HB3      ALA  18   2.999  -0.069  -1.977
  146    H    VAL  19           H        VAL  19   5.030  -0.686   1.128
  147    HA   VAL  19           HA       VAL  19   7.347   0.897   1.222
  148    HB   VAL  19           HB       VAL  19   5.766  -0.628   3.223
  149   HG11  VAL  19          HG11      VAL  19   7.892  -1.312   3.973
  150   HG12  VAL  19          HG12      VAL  19   8.603   0.270   3.650
  151   HG13  VAL  19          HG13      VAL  19   7.460   0.070   4.979
  152   HG21  VAL  19          HG21      VAL  19   6.771   2.205   3.001
  153   HG22  VAL  19          HG22      VAL  19   5.126   1.633   2.726
  154   HG23  VAL  19          HG23      VAL  19   5.813   1.593   4.349
  155    H    LYS  20           H        LYS  20   6.890  -2.595   1.634
  156    HA   LYS  20           HA       LYS  20   9.493  -3.284   2.341
  157    HB2  LYS  20           HB2      LYS  20   7.227  -4.719   1.035
  158    HB3  LYS  20           HB3      LYS  20   8.812  -5.482   1.022
  159    HG2  LYS  20           HG2      LYS  20   8.799  -5.875   3.254
  160    HG3  LYS  20           HG3      LYS  20   7.841  -4.437   3.615
  161    HD2  LYS  20           HD2      LYS  20   6.705  -6.854   2.225
  162    HD3  LYS  20           HD3      LYS  20   6.693  -6.664   3.980
  163    HE2  LYS  20           HE2      LYS  20   5.647  -4.428   2.326
  164    HE3  LYS  20           HE3      LYS  20   4.662  -5.884   2.462
  165    HZ1  LYS  20           HZ1      LYS  20   5.712  -4.328   4.762
  166    HZ2  LYS  20           HZ2      LYS  20   4.687  -5.670   4.846
  167    HZ3  LYS  20           HZ3      LYS  20   4.133  -4.224   4.164
  168    H    LYS  21           H        LYS  21   8.042  -2.877  -0.860
  169    HA   LYS  21           HA       LYS  21  10.246  -3.747  -2.372
  170    HB2  LYS  21           HB2      LYS  21   7.868  -3.332  -3.174
  171    HB3  LYS  21           HB3      LYS  21   8.282  -1.624  -3.229
  172    HG2  LYS  21           HG2      LYS  21  10.003  -3.592  -4.662
  173    HG3  LYS  21           HG3      LYS  21   8.462  -3.099  -5.368
  174    HD2  LYS  21           HD2      LYS  21  10.495  -1.101  -4.414
  175    HD3  LYS  21           HD3      LYS  21  10.534  -1.773  -6.046
  176    HE2  LYS  21           HE2      LYS  21   8.074  -0.483  -4.900
  177    HE3  LYS  21           HE3      LYS  21   9.324   0.449  -5.723
  178    HZ1  LYS  21           HZ1      LYS  21   8.992  -0.904  -7.692
  179    HZ2  LYS  21           HZ2      LYS  21   7.539  -0.173  -7.228
  180    HZ3  LYS  21           HZ3      LYS  21   7.801  -1.812  -6.903
  181    H    TYR  22           H        TYR  22   9.367  -0.566  -1.111
  182    HA   TYR  22           HA       TYR  22  11.354   0.928  -2.408
  183    HB2  TYR  22           HB2      TYR  22   9.793   1.329   0.128
  184    HB3  TYR  22           HB3      TYR  22  11.051   2.467  -0.341
  185    HD1  TYR  22           HD1      TYR  22   8.561   0.666  -2.451
  186    HD2  TYR  22           HD2      TYR  22   9.930   4.409  -0.961
  187    HE1  TYR  22           HE1      TYR  22   6.958   1.827  -3.912
  188    HE2  TYR  22           HE2      TYR  22   8.331   5.580  -2.417
  189    HH   TYR  22           HH       TYR  22   5.840   3.918  -4.123
  190    H    LEU  23           H        LEU  23  11.394  -0.894   0.608
  191    HA   LEU  23           HA       LEU  23  13.962  -0.005   1.449
  192    HB2  LEU  23           HB2      LEU  23  12.766  -2.635   2.236
  193    HB3  LEU  23           HB3      LEU  23  13.785  -1.553   3.183
  194    HG   LEU  23           HG       LEU  23  10.847  -1.493   2.731
  195   HD11  LEU  23          HD11      LEU  23  12.765  -1.467   4.961
  196   HD12  LEU  23          HD12      LEU  23  11.153  -2.174   4.852
  197   HD13  LEU  23          HD13      LEU  23  11.340  -0.450   5.170
  198   HD21  LEU  23          HD21      LEU  23  10.955   0.649   2.054
  199   HD22  LEU  23          HD22      LEU  23  12.606   0.863   2.635
  200   HD23  LEU  23          HD23      LEU  23  11.253   0.973   3.762
  201    H    ASN  24           H        ASN  24  12.809  -2.648  -0.543
  202    HA   ASN  24           HA       ASN  24  15.255  -4.096  -0.608
  203    HB2  ASN  24           HB2      ASN  24  14.166  -5.560  -1.985
  204    HB3  ASN  24           HB3      ASN  24  12.758  -4.731  -1.326
  205   HD21  ASN  24          HD21      ASN  24  15.116  -4.367  -3.953
  206   HD22  ASN  24          HD22      ASN  24  13.964  -3.884  -5.147
  207    H    SER  25           H        SER  25  13.723  -1.845  -2.900
  208    HA   SER  25           HA       SER  25  15.894  -1.871  -4.734
  209    HB2  SER  25           HB2      SER  25  13.682  -1.247  -5.499
  210    HB3  SER  25           HB3      SER  25  13.626   0.100  -4.362
  211    HG   SER  25           HG       SER  25  14.207   0.894  -6.365
  212    H    ILE  26           H        ILE  26  15.215  -0.112  -1.832
  213    HA   ILE  26           HA       ILE  26  17.166   1.959  -2.354
  214    HB   ILE  26           HB       ILE  26  15.441   1.298   0.018
  215   HG12  ILE  26          HG12      ILE  26  15.652   3.786  -1.689
  216   HG13  ILE  26          HG13      ILE  26  14.475   2.502  -1.946
  217   HG21  ILE  26          HG21      ILE  26  17.612   1.996   0.884
  218   HG22  ILE  26          HG22      ILE  26  17.558   3.439  -0.127
  219   HG23  ILE  26          HG23      ILE  26  16.387   3.231   1.175
  220   HD11  ILE  26          HD11      ILE  26  13.445   2.954   0.171
  221   HD12  ILE  26          HD12      ILE  26  14.696   4.132   0.571
  222   HD13  ILE  26          HD13      ILE  26  13.569   4.456  -0.745
  223    H    LEU  27           H        LEU  27  16.840  -0.570   0.146
  224    HA   LEU  27           HA       LEU  27  19.446  -0.313   1.151
  225    HB2  LEU  27           HB2      LEU  27  17.518  -2.623   1.184
  226    HB3  LEU  27           HB3      LEU  27  19.055  -2.632   2.047
  227    HG   LEU  27           HG       LEU  27  17.088  -0.445   2.573
  228   HD11  LEU  27          HD11      LEU  27  16.932  -2.837   4.292
  229   HD12  LEU  27          HD12      LEU  27  16.177  -2.965   2.703
  230   HD13  LEU  27          HD13      LEU  27  15.678  -1.692   3.817
  231   HD21  LEU  27          HD21      LEU  27  18.695   0.076   4.016
  232   HD22  LEU  27          HD22      LEU  27  19.564  -1.421   3.678
  233   HD23  LEU  27          HD23      LEU  27  18.295  -1.395   4.904
  234    H    ASN  28           H        ASN  28  18.105  -2.432  -1.346
  235    HA   ASN  28           HA       ASN  28  20.827  -3.353  -1.969
  236    HB2  ASN  28           HB2      ASN  28  18.127  -4.572  -2.240
  237    HB3  ASN  28           HB3      ASN  28  19.317  -4.972  -3.476
  238   HD21  ASN  28          HD21      ASN  28  18.015  -6.131  -0.811
  239   HD22  ASN  28          HD22      ASN  28  19.349  -6.992  -0.131
  240    H    GLY  29           H        GLY  29  19.560  -0.758  -2.744
  241    HA2  GLY  29           HA2      GLY  29  19.365   0.594  -4.593
  242    HA3  GLY  29           HA3      GLY  29  20.644  -0.415  -5.253
  Start of MODEL    9
    1    H1   HIS   1           H        HIS   1 -21.450   8.262  -0.772
    2    HA   HIS   1           HA       HIS   1 -18.754   7.422  -0.007
    3    HB2  HIS   1           HB2      HIS   1 -21.261   6.913   1.579
    4    HB3  HIS   1           HB3      HIS   1 -19.600   7.007   2.155
    5    HD1  HIS   1           HD1      HIS   1 -22.611   9.021   1.644
    6    HD2  HIS   1           HD2      HIS   1 -18.552   9.712   2.198
    7    HE1  HIS   1           HE1      HIS   1 -22.422  11.449   2.271
    8    HE2  HIS   1           HE2      HIS   1 -19.950  11.864   2.519
    9    H    SER   2           H        SER   2 -19.764   6.199  -2.298
   10    HA   SER   2           HA       SER   2 -20.881   3.634  -1.590
   11    HB2  SER   2           HB2      SER   2 -19.866   4.735  -4.219
   12    HB3  SER   2           HB3      SER   2 -20.612   3.148  -4.032
   13    HG   SER   2           HG       SER   2 -22.318   4.353  -4.505
   14    H    ASP   3           H        ASP   3 -19.565   2.301  -0.504
   15    HA   ASP   3           HA       ASP   3 -17.788   0.977   0.014
   16    HB2  ASP   3           HB2      ASP   3 -17.054   1.240  -2.906
   17    HB3  ASP   3           HB3      ASP   3 -16.611  -0.066  -1.810
   18    H    ALA   4           H        ALA   4 -17.428   3.698   0.509
   19    HA   ALA   4           HA       ALA   4 -14.950   4.670  -0.485
   20    HB1  ALA   4           HB1      ALA   4 -15.924   5.609   2.150
   21    HB2  ALA   4           HB2      ALA   4 -15.354   6.527   0.755
   22    HB3  ALA   4           HB3      ALA   4 -16.984   5.855   0.762
   23    H    VAL   5           H        VAL   5 -15.893   2.965   2.473
   24    HA   VAL   5           HA       VAL   5 -13.395   3.078   3.763
   25    HB   VAL   5           HB       VAL   5 -15.411   2.470   4.978
   26   HG11  VAL   5          HG11      VAL   5 -15.389  -0.197   3.595
   27   HG12  VAL   5          HG12      VAL   5 -16.639   0.497   4.629
   28   HG13  VAL   5          HG13      VAL   5 -16.363   1.154   3.016
   29   HG21  VAL   5          HG21      VAL   5 -14.539   0.374   6.104
   30   HG22  VAL   5          HG22      VAL   5 -13.243   0.385   4.908
   31   HG23  VAL   5          HG23      VAL   5 -13.423   1.738   6.025
   32    H    PHE   6           H        PHE   6 -14.783   0.735   1.510
   33    HA   PHE   6           HA       PHE   6 -12.789  -1.221   1.689
   34    HB2  PHE   6           HB2      PHE   6 -14.708  -0.454  -0.499
   35    HB3  PHE   6           HB3      PHE   6 -13.552  -1.765  -0.711
   36    HD1  PHE   6           HD2      PHE   6 -13.693  -3.777   0.709
   37    HD2  PHE   6           HD1      PHE   6 -16.648  -0.717   0.839
   38    HE1  PHE   6           HE2      PHE   6 -15.242  -5.325   1.831
   39    HE2  PHE   6           HE1      PHE   6 -18.201  -2.259   1.962
   40    HZ   PHE   6           HZ       PHE   6 -17.500  -4.567   2.459
   41    H    THR   7           H        THR   7 -13.150   1.395  -0.704
   42    HA   THR   7           HA       THR   7 -10.659   0.912  -1.964
   43    HB   THR   7           HB       THR   7 -12.501   2.128  -3.073
   44    HG1  THR   7           HG1      THR   7 -11.044   3.973  -3.750
   45   HG21  THR   7          HG21      THR   7 -11.810   4.295  -1.087
   46   HG22  THR   7          HG22      THR   7 -13.351   3.453  -1.252
   47   HG23  THR   7          HG23      THR   7 -12.801   4.542  -2.525
   48    H    ASP   8           H        ASP   8 -11.679   3.067   0.634
   49    HA   ASP   8           HA       ASP   8  -9.379   4.636   0.836
   50    HB2  ASP   8           HB2      ASP   8 -11.072   5.467   2.148
   51    HB3  ASP   8           HB3      ASP   8 -11.578   3.871   2.694
   52    H    ASN   9           H        ASN   9 -10.179   1.564   2.430
   53    HA   ASN   9           HA       ASN   9  -7.819   1.359   3.946
   54    HB2  ASN   9           HB2      ASN   9  -9.960   0.014   4.221
   55    HB3  ASN   9           HB3      ASN   9  -9.402  -0.978   2.878
   56   HD21  ASN   9          HD21      ASN   9  -9.389  -0.587   6.180
   57   HD22  ASN   9          HD22      ASN   9  -8.096  -1.664   6.574
   58    H    TYR  10           H        TYR  10  -8.521   0.672   0.616
   59    HA   TYR  10           HA       TYR  10  -6.359  -1.058   0.067
   60    HB2  TYR  10           HB2      TYR  10  -7.799   0.849  -1.789
   61    HB3  TYR  10           HB3      TYR  10  -6.750  -0.471  -2.294
   62    HD1  TYR  10           HD1      TYR  10  -8.118  -1.991   0.328
   63    HD2  TYR  10           HD2      TYR  10  -9.401  -0.378  -3.394
   64    HE1  TYR  10           HE1      TYR  10 -10.042  -3.523   0.334
   65    HE2  TYR  10           HE2      TYR  10 -11.329  -1.905  -3.398
   66    HH   TYR  10           HH       TYR  10 -12.042  -3.972  -0.638
   67    H    THR  11           H        THR  11  -6.657   2.434   0.181
   68    HA   THR  11           HA       THR  11  -4.213   3.068  -1.086
   69    HB   THR  11           HB       THR  11  -5.640   4.698   1.023
   70    HG1  THR  11           HG1      THR  11  -7.117   5.014  -0.447
   71   HG21  THR  11          HG21      THR  11  -4.037   5.779  -1.265
   72   HG22  THR  11          HG22      THR  11  -3.234   5.260   0.217
   73   HG23  THR  11          HG23      THR  11  -4.444   6.542   0.271
   74    H    ARG  12           H        ARG  12  -5.079   2.593   2.321
   75    HA   ARG  12           HA       ARG  12  -2.460   3.168   3.300
   76    HB2  ARG  12           HB2      ARG  12  -3.321   2.210   5.432
   77    HB3  ARG  12           HB3      ARG  12  -4.344   3.475   4.765
   78    HG2  ARG  12           HG2      ARG  12  -5.831   1.734   3.839
   79    HG3  ARG  12           HG3      ARG  12  -4.831   0.508   4.620
   80    HD2  ARG  12           HD2      ARG  12  -5.878   2.731   6.290
   81    HD3  ARG  12           HD3      ARG  12  -7.011   1.486   5.767
   82    HE   ARG  12           HE       ARG  12  -5.951  -0.034   7.144
   83   HH11  ARG  12          HH12      ARG  12  -4.130   2.930   6.991
   84   HH12  ARG  12          HH11      ARG  12  -3.088   2.510   8.310
   85   HH21  ARG  12          HH22      ARG  12  -4.586  -0.598   8.881
   86   HH22  ARG  12          HH21      ARG  12  -3.348   0.503   9.384
   87    H    LEU  13           H        LEU  13  -4.262   0.184   2.650
   88    HA   LEU  13           HA       LEU  13  -2.370  -1.636   3.603
   89    HB2  LEU  13           HB2      LEU  13  -4.616  -2.315   3.060
   90    HB3  LEU  13           HB3      LEU  13  -4.371  -1.898   1.365
   91    HG   LEU  13           HG       LEU  13  -2.464  -3.728   1.574
   92   HD11  LEU  13          HD11      LEU  13  -2.469  -4.828   3.500
   93   HD12  LEU  13          HD12      LEU  13  -4.065  -5.452   3.085
   94   HD13  LEU  13          HD13      LEU  13  -3.916  -3.978   4.041
   95   HD21  LEU  13          HD21      LEU  13  -3.825  -5.082   0.344
   96   HD22  LEU  13          HD22      LEU  13  -4.751  -3.583   0.255
   97   HD23  LEU  13          HD23      LEU  13  -5.214  -4.839   1.404
   98    H    ARG  14           H        ARG  14  -2.702  -0.105   0.435
   99    HA   ARG  14           HA       ARG  14  -0.751  -1.563  -0.936
  100    HB2  ARG  14           HB2      ARG  14  -2.473   0.295  -1.711
  101    HB3  ARG  14           HB3      ARG  14  -1.082   1.350  -1.496
  102    HG2  ARG  14           HG2      ARG  14   0.130  -0.447  -2.959
  103    HG3  ARG  14           HG3      ARG  14  -1.515  -0.840  -3.464
  104    HD2  ARG  14           HD2      ARG  14  -1.873   1.313  -4.338
  105    HD3  ARG  14           HD3      ARG  14  -0.469   1.975  -3.501
  106    HE   ARG  14           HE       ARG  14   0.173  -0.082  -5.405
  107   HH11  ARG  14          HH12      ARG  14  -0.394   3.321  -4.941
  108   HH12  ARG  14          HH11      ARG  14   0.522   3.797  -6.332
  109   HH21  ARG  14          HH22      ARG  14   1.382   0.531  -7.240
  110   HH22  ARG  14          HH21      ARG  14   1.531   2.209  -7.640
  111    H    LYS  15           H        LYS  15  -0.484   1.237   1.179
  112    HA   LYS  15           HA       LYS  15   2.162   1.952   0.654
  113    HB2  LYS  15           HB2      LYS  15   0.486   3.224   2.049
  114    HB3  LYS  15           HB3      LYS  15   0.818   2.093   3.354
  115    HG2  LYS  15           HG2      LYS  15   2.166   3.912   3.848
  116    HG3  LYS  15           HG3      LYS  15   3.272   2.784   3.059
  117    HD2  LYS  15           HD2      LYS  15   2.711   4.038   0.898
  118    HD3  LYS  15           HD3      LYS  15   2.026   5.282   1.946
  119    HE2  LYS  15           HE2      LYS  15   4.857   4.250   2.082
  120    HE3  LYS  15           HE3      LYS  15   4.360   5.755   1.310
  121    HZ1  LYS  15           HZ1      LYS  15   5.042   5.378   3.962
  122    HZ2  LYS  15           HZ2      LYS  15   3.370   5.635   3.958
  123    HZ3  LYS  15           HZ3      LYS  15   4.403   6.778   3.259
  124    H    GLN  16           H        GLN  16   0.849  -0.377   2.986
  125    HA   GLN  16           HA       GLN  16   3.258  -1.079   4.220
  126    HB2  GLN  16           HB2      GLN  16   0.602  -2.397   3.891
  127    HB3  GLN  16           HB3      GLN  16   1.942  -3.361   4.495
  128    HG2  GLN  16           HG2      GLN  16   1.066  -0.757   5.717
  129    HG3  GLN  16           HG3      GLN  16   0.505  -2.340   6.254
  130   HE21  GLN  16          HE21      GLN  16   3.117  -0.089   6.211
  131   HE22  GLN  16          HE22      GLN  16   4.149  -0.938   7.306
  132    H    MET  17           H        MET  17   1.627  -2.496   1.403
  133    HA   MET  17           HA       MET  17   3.584  -4.507   0.963
  134    HB2  MET  17           HB2      MET  17   1.621  -3.318  -1.005
  135    HB3  MET  17           HB3      MET  17   2.481  -4.841  -1.189
  136    HG2  MET  17           HG2      MET  17   1.319  -5.465   1.046
  137    HG3  MET  17           HG3      MET  17   0.219  -4.154   0.628
  138    HE1  MET  17           HE1      MET  17   0.974  -7.831  -2.026
  139    HE2  MET  17           HE2      MET  17   2.197  -6.827  -1.248
  140    HE3  MET  17           HE3      MET  17   1.235  -7.949  -0.286
  141    H    ALA  18           H        ALA  18   3.139  -1.224  -0.226
  142    HA   ALA  18           HA       ALA  18   5.221  -1.358  -2.177
  143    HB1  ALA  18           HB1      ALA  18   3.239   0.522  -1.371
  144    HB2  ALA  18           HB2      ALA  18   4.808   1.328  -1.399
  145    HB3  ALA  18           HB3      ALA  18   4.215   0.503  -2.840
  146    H    VAL  19           H        VAL  19   5.087  -0.697   1.225
  147    HA   VAL  19           HA       VAL  19   7.463   0.766   1.535
  148    HB   VAL  19           HB       VAL  19   5.759  -0.875   3.331
  149   HG11  VAL  19          HG11      VAL  19   7.433  -0.442   5.191
  150   HG12  VAL  19          HG12      VAL  19   7.829  -1.737   4.059
  151   HG13  VAL  19          HG13      VAL  19   8.621  -0.167   3.917
  152   HG21  VAL  19          HG21      VAL  19   5.878   1.213   4.680
  153   HG22  VAL  19          HG22      VAL  19   6.903   1.913   3.427
  154   HG23  VAL  19          HG23      VAL  19   5.242   1.453   3.053
  155    H    LYS  20           H        LYS  20   6.863  -2.734   1.703
  156    HA   LYS  20           HA       LYS  20   9.446  -3.557   2.335
  157    HB2  LYS  20           HB2      LYS  20   7.088  -4.821   1.037
  158    HB3  LYS  20           HB3      LYS  20   8.636  -5.636   0.857
  159    HG2  LYS  20           HG2      LYS  20   8.760  -6.193   3.056
  160    HG3  LYS  20           HG3      LYS  20   7.852  -4.773   3.582
  161    HD2  LYS  20           HD2      LYS  20   6.650  -7.135   2.140
  162    HD3  LYS  20           HD3      LYS  20   6.628  -6.916   3.892
  163    HE2  LYS  20           HE2      LYS  20   5.607  -4.566   3.197
  164    HE3  LYS  20           HE3      LYS  20   5.126  -5.480   1.768
  165    HZ1  LYS  20           HZ1      LYS  20   4.589  -6.845   4.241
  166    HZ2  LYS  20           HZ2      LYS  20   3.577  -6.579   2.912
  167    HZ3  LYS  20           HZ3      LYS  20   3.753  -5.382   4.094
  168    H    LYS  21           H        LYS  21   7.956  -3.040  -0.845
  169    HA   LYS  21           HA       LYS  21  10.130  -3.861  -2.408
  170    HB2  LYS  21           HB2      LYS  21   7.914  -3.529  -3.357
  171    HB3  LYS  21           HB3      LYS  21   7.990  -1.808  -3.000
  172    HG2  LYS  21           HG2      LYS  21   8.534  -1.785  -5.211
  173    HG3  LYS  21           HG3      LYS  21  10.145  -1.926  -4.503
  174    HD2  LYS  21           HD2      LYS  21  10.141  -4.315  -4.875
  175    HD3  LYS  21           HD3      LYS  21   8.478  -4.251  -5.463
  176    HE2  LYS  21           HE2      LYS  21  10.822  -2.853  -6.748
  177    HE3  LYS  21           HE3      LYS  21  10.155  -4.396  -7.279
  178    HZ1  LYS  21           HZ1      LYS  21   8.899  -1.723  -7.381
  179    HZ2  LYS  21           HZ2      LYS  21   7.974  -3.135  -7.486
  180    HZ3  LYS  21           HZ3      LYS  21   9.161  -2.815  -8.647
  181    H    TYR  22           H        TYR  22   9.321  -0.709  -1.028
  182    HA   TYR  22           HA       TYR  22  11.319   0.798  -2.286
  183    HB2  TYR  22           HB2      TYR  22   9.772   1.117   0.265
  184    HB3  TYR  22           HB3      TYR  22  11.078   2.233  -0.118
  185    HD1  TYR  22           HD1      TYR  22   8.621   0.664  -2.430
  186    HD2  TYR  22           HD2      TYR  22   9.974   4.243  -0.568
  187    HE1  TYR  22           HE1      TYR  22   7.085   1.971  -3.838
  188    HE2  TYR  22           HE2      TYR  22   8.441   5.559  -1.970
  189    HH   TYR  22           HH       TYR  22   7.320   5.149  -4.357
  190    H    LEU  23           H        LEU  23  11.371  -1.143   0.656
  191    HA   LEU  23           HA       LEU  23  13.957  -0.336   1.508
  192    HB2  LEU  23           HB2      LEU  23  12.709  -2.986   2.150
  193    HB3  LEU  23           HB3      LEU  23  13.797  -2.013   3.138
  194    HG   LEU  23           HG       LEU  23  10.856  -1.848   2.815
  195   HD11  LEU  23          HD11      LEU  23  11.445  -0.893   5.251
  196   HD12  LEU  23          HD12      LEU  23  12.886  -1.865   4.957
  197   HD13  LEU  23          HD13      LEU  23  11.291  -2.613   4.893
  198   HD21  LEU  23          HD21      LEU  23  11.136   0.301   2.060
  199   HD22  LEU  23          HD22      LEU  23  12.671   0.516   2.902
  200   HD23  LEU  23          HD23      LEU  23  11.155   0.561   3.804
  201    H    ASN  24           H        ASN  24  12.757  -2.967  -0.508
  202    HA   ASN  24           HA       ASN  24  15.193  -4.384  -0.711
  203    HB2  ASN  24           HB2      ASN  24  14.083  -5.767  -2.160
  204    HB3  ASN  24           HB3      ASN  24  12.691  -4.976  -1.427
  205   HD21  ASN  24          HD21      ASN  24  14.995  -4.472  -4.078
  206   HD22  ASN  24          HD22      ASN  24  13.821  -3.916  -5.218
  207    H    SER  25           H        SER  25  13.654  -2.026  -2.890
  208    HA   SER  25           HA       SER  25  15.818  -1.976  -4.732
  209    HB2  SER  25           HB2      SER  25  14.683   0.028  -5.657
  210    HB3  SER  25           HB3      SER  25  13.574  -1.324  -5.427
  211    HG   SER  25           HG       SER  25  13.915   0.849  -3.630
  212    H    ILE  26           H        ILE  26  15.015  -0.153  -1.855
  213    HA   ILE  26           HA       ILE  26  16.956   1.903  -2.257
  214    HB   ILE  26           HB       ILE  26  15.373   1.024   0.146
  215   HG12  ILE  26          HG12      ILE  26  15.354   3.689  -1.259
  216   HG13  ILE  26          HG13      ILE  26  14.376   2.340  -1.826
  217   HG21  ILE  26          HG21      ILE  26  17.134   1.824   1.331
  218   HG22  ILE  26          HG22      ILE  26  17.714   2.828   0.003
  219   HG23  ILE  26          HG23      ILE  26  16.346   3.362   0.979
  220   HD11  ILE  26          HD11      ILE  26  13.983   4.124   0.447
  221   HD12  ILE  26          HD12      ILE  26  12.816   3.170  -0.470
  222   HD13  ILE  26          HD13      ILE  26  13.748   2.417   0.824
  223    H    LEU  27           H        LEU  27  16.820  -0.787   0.087
  224    HA   LEU  27           HA       LEU  27  19.457  -0.500   1.000
  225    HB2  LEU  27           HB2      LEU  27  17.595  -2.863   0.971
  226    HB3  LEU  27           HB3      LEU  27  19.176  -2.894   1.750
  227    HG   LEU  27           HG       LEU  27  16.936  -1.016   2.496
  228   HD11  LEU  27          HD11      LEU  27  16.107  -2.541   3.893
  229   HD12  LEU  27          HD12      LEU  27  17.709  -3.045   4.430
  230   HD13  LEU  27          HD13      LEU  27  17.019  -3.727   2.957
  231   HD21  LEU  27          HD21      LEU  27  19.590  -1.635   3.788
  232   HD22  LEU  27          HD22      LEU  27  18.319  -0.647   4.508
  233   HD23  LEU  27          HD23      LEU  27  19.115  -0.118   3.025
  234    H    ASN  28           H        ASN  28  18.084  -2.412  -1.628
  235    HA   ASN  28           HA       ASN  28  20.313  -3.963  -2.259
  236    HB2  ASN  28           HB2      ASN  28  18.183  -4.457  -3.262
  237    HB3  ASN  28           HB3      ASN  28  18.118  -2.873  -4.028
  238   HD21  ASN  28          HD21      ASN  28  18.182  -5.765  -4.983
  239   HD22  ASN  28          HD22      ASN  28  19.380  -5.756  -6.227
  240    H    GLY  29           H        GLY  29  19.517  -0.644  -3.094
  241    HA2  GLY  29           HA2      GLY  29  21.424  -0.226  -5.107
  242    HA3  GLY  29           HA3      GLY  29  20.755   1.024  -4.068
  Start of MODEL   10
    1    H1   HIS   1           H        HIS   1 -23.739   4.263  -2.739
    2    HA   HIS   1           HA       HIS   1 -22.704   6.863  -3.231
    3    HB2  HIS   1           HB2      HIS   1 -23.753   5.873  -1.065
    4    HB3  HIS   1           HB3      HIS   1 -22.119   5.308  -0.729
    5    HD1  HIS   1           HD1      HIS   1 -20.831   6.874   0.668
    6    HD2  HIS   1           HD2      HIS   1 -23.652   8.855  -1.651
    7    HE1  HIS   1           HE1      HIS   1 -20.628   9.301   1.291
    8    HE2  HIS   1           HE2      HIS   1 -22.402  10.469  -0.061
    9    H    SER   2           H        SER   2 -20.481   7.486  -2.332
   10    HA   SER   2           HA       SER   2 -18.509   6.197  -3.900
   11    HB2  SER   2           HB2      SER   2 -18.395   8.591  -3.352
   12    HB3  SER   2           HB3      SER   2 -18.166   8.195  -1.649
   13    HG   SER   2           HG       SER   2 -16.130   8.283  -2.213
   14    H    ASP   3           H        ASP   3 -17.196   4.550  -3.459
   15    HA   ASP   3           HA       ASP   3 -17.411   3.219  -0.901
   16    HB2  ASP   3           HB2      ASP   3 -15.539   2.365  -3.085
   17    HB3  ASP   3           HB3      ASP   3 -16.410   1.373  -1.918
   18    H    ALA   4           H        ALA   4 -16.303   5.631  -0.428
   19    HA   ALA   4           HA       ALA   4 -13.586   5.997  -0.605
   20    HB1  ALA   4           HB1      ALA   4 -14.263   6.871   1.969
   21    HB2  ALA   4           HB2      ALA   4 -14.224   7.823   0.484
   22    HB3  ALA   4           HB3      ALA   4 -15.724   7.049   0.997
   23    H    VAL   5           H        VAL   5 -15.350   4.193   1.899
   24    HA   VAL   5           HA       VAL   5 -13.143   3.497   3.474
   25    HB   VAL   5           HB       VAL   5 -15.461   3.220   4.234
   26   HG11  VAL   5          HG11      VAL   5 -16.322   2.373   2.044
   27   HG12  VAL   5          HG12      VAL   5 -15.590   0.813   2.425
   28   HG13  VAL   5          HG13      VAL   5 -16.873   1.461   3.449
   29   HG21  VAL   5          HG21      VAL   5 -13.585   0.892   4.278
   30   HG22  VAL   5          HG22      VAL   5 -14.005   2.016   5.570
   31   HG23  VAL   5          HG23      VAL   5 -15.156   0.776   5.070
   32    H    PHE   6           H        PHE   6 -14.563   1.936   0.646
   33    HA   PHE   6           HA       PHE   6 -13.120  -0.461   0.731
   34    HB2  PHE   6           HB2      PHE   6 -14.485   1.087  -1.436
   35    HB3  PHE   6           HB3      PHE   6 -13.473  -0.285  -1.874
   36    HD1  PHE   6           HD1      PHE   6 -16.323   0.668   0.312
   37    HD2  PHE   6           HD2      PHE   6 -14.341  -2.432  -1.828
   38    HE1  PHE   6           HE1      PHE   6 -18.190  -0.858   0.801
   39    HE2  PHE   6           HE2      PHE   6 -16.206  -3.962  -1.344
   40    HZ   PHE   6           HZ       PHE   6 -18.134  -3.176  -0.029
   41    H    THR   7           H        THR   7 -12.433   2.500  -1.132
   42    HA   THR   7           HA       THR   7  -9.916   1.609  -2.076
   43    HB   THR   7           HB       THR   7 -11.228   3.420  -3.160
   44    HG1  THR   7           HG1      THR   7  -9.230   3.603  -3.894
   45   HG21  THR   7          HG21      THR   7 -10.331   5.020  -0.761
   46   HG22  THR   7          HG22      THR   7 -11.991   4.630  -1.210
   47   HG23  THR   7          HG23      THR   7 -11.034   5.709  -2.224
   48    H    ASP   8           H        ASP   8 -10.913   3.517   0.716
   49    HA   ASP   8           HA       ASP   8  -8.435   4.442   1.570
   50    HB2  ASP   8           HB2      ASP   8 -11.037   3.870   2.895
   51    HB3  ASP   8           HB3      ASP   8  -9.632   4.084   3.936
   52    H    ASN   9           H        ASN   9 -10.022   1.339   2.181
   53    HA   ASN   9           HA       ASN   9  -8.121   0.331   3.999
   54    HB2  ASN   9           HB2      ASN   9 -10.244  -0.867   2.272
   55    HB3  ASN   9           HB3      ASN   9  -9.055  -1.940   3.005
   56   HD21  ASN   9          HD21      ASN   9  -8.647  -1.244   5.423
   57   HD22  ASN   9          HD22      ASN   9 -10.091  -1.097   6.359
   58    H    TYR  10           H        TYR  10  -8.375   0.116   0.477
   59    HA   TYR  10           HA       TYR  10  -6.190  -1.634   0.101
   60    HB2  TYR  10           HB2      TYR  10  -7.254   0.426  -1.840
   61    HB3  TYR  10           HB3      TYR  10  -6.304  -1.001  -2.238
   62    HD1  TYR  10           HD1      TYR  10  -7.713  -2.967  -0.423
   63    HD2  TYR  10           HD2      TYR  10  -9.212  -0.006  -3.086
   64    HE1  TYR  10           HE1      TYR  10  -9.781  -4.270  -0.699
   65    HE2  TYR  10           HE2      TYR  10 -11.284  -1.300  -3.368
   66    HH   TYR  10           HH       TYR  10 -12.511  -3.016  -2.536
   67    H    THR  11           H        THR  11  -6.446   1.849   0.397
   68    HA   THR  11           HA       THR  11  -3.882   2.538  -0.532
   69    HB   THR  11           HB       THR  11  -5.523   3.976   1.563
   70    HG1  THR  11           HG1      THR  11  -6.552   3.587  -0.543
   71   HG21  THR  11          HG21      THR  11  -4.235   5.893   1.109
   72   HG22  THR  11          HG22      THR  11  -3.527   5.179  -0.340
   73   HG23  THR  11          HG23      THR  11  -3.059   4.588   1.254
   74    H    ARG  12           H        ARG  12  -5.065   1.639   2.675
   75    HA   ARG  12           HA       ARG  12  -2.589   2.133   4.003
   76    HB2  ARG  12           HB2      ARG  12  -4.975   0.467   4.824
   77    HB3  ARG  12           HB3      ARG  12  -3.622   0.865   5.875
   78    HG2  ARG  12           HG2      ARG  12  -4.160   3.260   5.598
   79    HG3  ARG  12           HG3      ARG  12  -5.570   2.800   4.642
   80    HD2  ARG  12           HD2      ARG  12  -6.696   1.955   6.458
   81    HD3  ARG  12           HD3      ARG  12  -5.214   1.607   7.348
   82    HE   ARG  12           HE       ARG  12  -5.195   4.282   7.278
   83   HH11  ARG  12          HH12      ARG  12  -7.701   2.007   8.094
   84   HH12  ARG  12          HH11      ARG  12  -8.480   3.070   9.219
   85   HH21  ARG  12          HH22      ARG  12  -6.212   5.691   8.756
   86   HH22  ARG  12          HH21      ARG  12  -7.633   5.165   9.594
   87    H    LEU  13           H        LEU  13  -4.121  -0.709   2.583
   88    HA   LEU  13           HA       LEU  13  -2.164  -2.564   3.501
   89    HB2  LEU  13           HB2      LEU  13  -4.390  -3.295   2.899
   90    HB3  LEU  13           HB3      LEU  13  -4.158  -2.729   1.247
   91    HG   LEU  13           HG       LEU  13  -2.148  -4.476   1.356
   92   HD11  LEU  13          HD11      LEU  13  -3.949  -5.181   3.592
   93   HD12  LEU  13          HD12      LEU  13  -2.224  -5.480   3.383
   94   HD13  LEU  13          HD13      LEU  13  -3.402  -6.502   2.558
   95   HD21  LEU  13          HD21      LEU  13  -3.974  -4.441  -0.277
   96   HD22  LEU  13          HD22      LEU  13  -5.034  -5.225   0.894
   97   HD23  LEU  13          HD23      LEU  13  -3.623  -6.080   0.271
   98    H    ARG  14           H        ARG  14  -2.604  -0.698   0.540
   99    HA   ARG  14           HA       ARG  14  -0.501  -1.918  -0.916
  100    HB2  ARG  14           HB2      ARG  14  -0.992  -0.426  -2.580
  101    HB3  ARG  14           HB3      ARG  14  -2.484  -0.322  -1.657
  102    HG2  ARG  14           HG2      ARG  14  -1.788   1.713  -0.622
  103    HG3  ARG  14           HG3      ARG  14  -0.168   1.565  -1.307
  104    HD2  ARG  14           HD2      ARG  14  -0.873   2.128  -3.433
  105    HD3  ARG  14           HD3      ARG  14  -2.537   1.637  -3.122
  106    HE   ARG  14           HE       ARG  14  -2.965   3.719  -2.226
  107   HH11  ARG  14          HH12      ARG  14   0.449   3.332  -2.788
  108   HH12  ARG  14          HH11      ARG  14   0.814   5.006  -2.527
  109   HH21  ARG  14          HH22      ARG  14  -2.497   5.925  -1.880
  110   HH22  ARG  14          HH21      ARG  14  -0.862   6.479  -2.010
  111    H    LYS  15           H        LYS  15  -0.665   0.839   1.262
  112    HA   LYS  15           HA       LYS  15   1.890   1.899   0.751
  113    HB2  LYS  15           HB2      LYS  15   0.183   3.151   1.966
  114    HB3  LYS  15           HB3      LYS  15   0.231   1.981   3.278
  115    HG2  LYS  15           HG2      LYS  15   1.494   3.765   4.065
  116    HG3  LYS  15           HG3      LYS  15   2.703   2.611   3.498
  117    HD2  LYS  15           HD2      LYS  15   2.431   3.977   1.250
  118    HD3  LYS  15           HD3      LYS  15   1.894   5.240   2.360
  119    HE2  LYS  15           HE2      LYS  15   4.011   4.808   3.670
  120    HE3  LYS  15           HE3      LYS  15   4.543   3.811   2.318
  121    HZ1  LYS  15           HZ1      LYS  15   3.605   6.420   1.543
  122    HZ2  LYS  15           HZ2      LYS  15   5.015   5.601   1.094
  123    HZ3  LYS  15           HZ3      LYS  15   4.965   6.465   2.548
  124    H    GLN  16           H        GLN  16   0.781  -0.650   2.909
  125    HA   GLN  16           HA       GLN  16   3.245  -0.958   4.295
  126    HB2  GLN  16           HB2      GLN  16   0.699  -2.478   4.086
  127    HB3  GLN  16           HB3      GLN  16   2.114  -3.354   4.654
  128    HG2  GLN  16           HG2      GLN  16   1.119  -0.787   5.865
  129    HG3  GLN  16           HG3      GLN  16   0.705  -2.395   6.458
  130   HE21  GLN  16          HE21      GLN  16   2.192  -0.134   7.680
  131   HE22  GLN  16          HE22      GLN  16   3.700  -0.808   8.186
  132    H    MET  17           H        MET  17   1.746  -2.684   1.578
  133    HA   MET  17           HA       MET  17   3.887  -4.521   1.238
  134    HB2  MET  17           HB2      MET  17   1.792  -3.647  -0.759
  135    HB3  MET  17           HB3      MET  17   2.811  -5.074  -0.892
  136    HG2  MET  17           HG2      MET  17   1.738  -5.653   1.435
  137    HG3  MET  17           HG3      MET  17   0.472  -4.567   0.867
  138    HE1  MET  17           HE1      MET  17   0.827  -8.421   1.035
  139    HE2  MET  17           HE2      MET  17  -0.148  -7.145   1.763
  140    HE3  MET  17           HE3      MET  17  -0.853  -8.204   0.540
  141    H    ALA  18           H        ALA  18   3.132  -1.364  -0.113
  142    HA   ALA  18           HA       ALA  18   5.188  -1.411  -2.094
  143    HB1  ALA  18           HB1      ALA  18   3.075   0.031  -2.058
  144    HB2  ALA  18           HB2      ALA  18   3.970   1.086  -0.963
  145    HB3  ALA  18           HB3      ALA  18   4.575   0.789  -2.593
  146    H    VAL  19           H        VAL  19   5.043  -0.588   1.273
  147    HA   VAL  19           HA       VAL  19   7.288   1.088   1.463
  148    HB   VAL  19           HB       VAL  19   5.771  -0.607   3.380
  149   HG11  VAL  19          HG11      VAL  19   8.558   0.409   3.844
  150   HG12  VAL  19          HG12      VAL  19   7.424   0.151   5.172
  151   HG13  VAL  19          HG13      VAL  19   7.906  -1.201   4.147
  152   HG21  VAL  19          HG21      VAL  19   5.883   2.105   2.645
  153   HG22  VAL  19          HG22      VAL  19   4.903   1.369   3.913
  154   HG23  VAL  19          HG23      VAL  19   6.502   2.008   4.293
  155    H    LYS  20           H        LYS  20   6.991  -2.436   1.823
  156    HA   LYS  20           HA       LYS  20   9.725  -2.906   2.358
  157    HB2  LYS  20           HB2      LYS  20   7.385  -4.572   1.581
  158    HB3  LYS  20           HB3      LYS  20   8.985  -5.266   1.355
  159    HG2  LYS  20           HG2      LYS  20   9.380  -5.438   3.581
  160    HG3  LYS  20           HG3      LYS  20   8.414  -4.014   3.976
  161    HD2  LYS  20           HD2      LYS  20   7.068  -6.468   2.931
  162    HD3  LYS  20           HD3      LYS  20   7.568  -6.403   4.623
  163    HE2  LYS  20           HE2      LYS  20   6.065  -4.089   3.519
  164    HE3  LYS  20           HE3      LYS  20   5.175  -5.579   3.825
  165    HZ1  LYS  20           HZ1      LYS  20   5.709  -5.503   6.092
  166    HZ2  LYS  20           HZ2      LYS  20   5.273  -3.917   5.701
  167    HZ3  LYS  20           HZ3      LYS  20   6.905  -4.327   5.875
  168    H    LYS  21           H        LYS  21   7.851  -2.775  -0.620
  169    HA   LYS  21           HA       LYS  21   9.855  -3.769  -2.345
  170    HB2  LYS  21           HB2      LYS  21   7.487  -3.637  -2.985
  171    HB3  LYS  21           HB3      LYS  21   7.570  -1.881  -2.946
  172    HG2  LYS  21           HG2      LYS  21   7.718  -2.474  -5.210
  173    HG3  LYS  21           HG3      LYS  21   9.364  -2.062  -4.723
  174    HD2  LYS  21           HD2      LYS  21   9.767  -4.019  -5.836
  175    HD3  LYS  21           HD3      LYS  21   9.482  -4.654  -4.213
  176    HE2  LYS  21           HE2      LYS  21   7.388  -4.433  -6.373
  177    HE3  LYS  21           HE3      LYS  21   8.283  -5.902  -5.987
  178    HZ1  LYS  21           HZ1      LYS  21   6.372  -6.172  -4.772
  179    HZ2  LYS  21           HZ2      LYS  21   6.214  -4.526  -4.417
  180    HZ3  LYS  21           HZ3      LYS  21   7.379  -5.456  -3.616
  181    H    TYR  22           H        TYR  22   8.998  -0.491  -1.319
  182    HA   TYR  22           HA       TYR  22  10.860   0.839  -2.988
  183    HB2  TYR  22           HB2      TYR  22   9.251   1.595  -0.583
  184    HB3  TYR  22           HB3      TYR  22  10.545   2.665  -1.112
  185    HD1  TYR  22           HD1      TYR  22   7.958   0.660  -2.927
  186    HD2  TYR  22           HD2      TYR  22   9.686   4.486  -2.231
  187    HE1  TYR  22           HE1      TYR  22   6.453   1.639  -4.608
  188    HE2  TYR  22           HE2      TYR  22   8.185   5.475  -3.909
  189    HH   TYR  22           HH       TYR  22   6.102   3.485  -5.913
  190    H    LEU  23           H        LEU  23  10.962   0.067   0.491
  191    HA   LEU  23           HA       LEU  23  13.589   0.981   0.913
  192    HB2  LEU  23           HB2      LEU  23  13.504  -0.248   2.999
  193    HB3  LEU  23           HB3      LEU  23  11.993   0.616   2.722
  194    HG   LEU  23           HG       LEU  23  11.221  -1.717   1.771
  195   HD11  LEU  23          HD11      LEU  23  13.723  -2.455   2.372
  196   HD12  LEU  23          HD12      LEU  23  12.352  -3.563   2.416
  197   HD13  LEU  23          HD13      LEU  23  12.934  -2.823   3.907
  198   HD21  LEU  23          HD21      LEU  23   9.879  -1.263   3.491
  199   HD22  LEU  23          HD22      LEU  23  11.167  -0.457   4.386
  200   HD23  LEU  23          HD23      LEU  23  10.992  -2.210   4.478
  201    H    ASN  24           H        ASN  24  12.311  -2.055  -0.247
  202    HA   ASN  24           HA       ASN  24  14.641  -3.618   0.103
  203    HB2  ASN  24           HB2      ASN  24  12.525  -4.708  -0.269
  204    HB3  ASN  24           HB3      ASN  24  12.322  -3.893  -1.817
  205   HD21  ASN  24          HD21      ASN  24  12.641  -5.184  -3.462
  206   HD22  ASN  24          HD22      ASN  24  13.785  -6.476  -3.544
  207    H    SER  25           H        SER  25  13.425  -1.713  -2.628
  208    HA   SER  25           HA       SER  25  15.481  -2.401  -4.435
  209    HB2  SER  25           HB2      SER  25  13.424  -1.440  -5.262
  210    HB3  SER  25           HB3      SER  25  13.677   0.027  -4.316
  211    HG   SER  25           HG       SER  25  14.362  -0.236  -6.739
  212    H    ILE  26           H        ILE  26  15.040   0.492  -2.402
  213    HA   ILE  26           HA       ILE  26  17.434   1.764  -3.078
  214    HB   ILE  26           HB       ILE  26  15.708   1.903  -0.621
  215   HG12  ILE  26          HG12      ILE  26  14.880   3.873  -1.532
  216   HG13  ILE  26          HG13      ILE  26  16.327   4.158  -2.492
  217   HG21  ILE  26          HG21      ILE  26  17.548   2.590   0.481
  218   HG22  ILE  26          HG22      ILE  26  18.436   2.935  -1.003
  219   HG23  ILE  26          HG23      ILE  26  17.263   4.099  -0.386
  220   HD11  ILE  26          HD11      ILE  26  14.457   3.598  -3.912
  221   HD12  ILE  26          HD12      ILE  26  15.678   2.327  -3.983
  222   HD13  ILE  26          HD13      ILE  26  14.211   2.089  -3.033
  223    H    LEU  27           H        LEU  27  16.712  -0.462  -0.404
  224    HA   LEU  27           HA       LEU  27  19.394  -0.437   0.593
  225    HB2  LEU  27           HB2      LEU  27  17.156  -2.386   1.120
  226    HB3  LEU  27           HB3      LEU  27  18.649  -2.251   2.048
  227    HG   LEU  27           HG       LEU  27  16.636  -0.021   1.834
  228   HD11  LEU  27          HD11      LEU  27  16.385  -2.492   3.228
  229   HD12  LEU  27          HD12      LEU  27  15.297  -1.104   3.226
  230   HD13  LEU  27          HD13      LEU  27  16.608  -1.195   4.402
  231   HD21  LEU  27          HD21      LEU  27  19.206  -0.446   3.210
  232   HD22  LEU  27          HD22      LEU  27  17.931   0.294   4.177
  233   HD23  LEU  27          HD23      LEU  27  18.440   1.046   2.665
  234    H    ASN  28           H        ASN  28  17.614  -2.335  -1.718
  235    HA   ASN  28           HA       ASN  28  19.169  -4.640  -1.827
  236    HB2  ASN  28           HB2      ASN  28  17.220  -4.767  -3.085
  237    HB3  ASN  28           HB3      ASN  28  17.472  -3.187  -3.823
  238   HD21  ASN  28          HD21      ASN  28  17.884  -3.314  -5.895
  239   HD22  ASN  28          HD22      ASN  28  18.778  -4.561  -6.688
  240    H    GLY  29           H        GLY  29  19.772  -1.437  -3.082
  241    HA2  GLY  29           HA2      GLY  29  22.511  -2.231  -3.701
  242    HA3  GLY  29           HA3      GLY  29  21.562  -1.587  -5.033
  Start of MODEL   11
    1    H1   HIS   1           H        HIS   1 -23.022   0.999  -2.732
    2    HA   HIS   1           HA       HIS   1 -22.428   3.575  -3.222
    3    HB2  HIS   1           HB2      HIS   1 -24.542   2.557  -2.146
    4    HB3  HIS   1           HB3      HIS   1 -23.745   2.875  -0.608
    5    HD1  HIS   1           HD1      HIS   1 -24.993   4.725  -3.667
    6    HD2  HIS   1           HD2      HIS   1 -23.985   5.440   0.299
    7    HE1  HIS   1           HE1      HIS   1 -25.675   7.103  -3.219
    8    HE2  HIS   1           HE2      HIS   1 -24.978   7.540  -0.839
    9    H    SER   2           H        SER   2 -21.736   2.016  -0.088
   10    HA   SER   2           HA       SER   2 -20.000   4.233   0.646
   11    HB2  SER   2           HB2      SER   2 -20.986   1.797   2.131
   12    HB3  SER   2           HB3      SER   2 -19.768   2.882   2.801
   13    HG   SER   2           HG       SER   2 -21.683   3.658   3.521
   14    H    ASP   3           H        ASP   3 -18.963   2.996  -1.523
   15    HA   ASP   3           HA       ASP   3 -17.165   0.882  -0.929
   16    HB2  ASP   3           HB2      ASP   3 -16.792   2.871  -3.160
   17    HB3  ASP   3           HB3      ASP   3 -16.321   1.175  -3.118
   18    H    ALA   4           H        ALA   4 -17.161   4.019   0.099
   19    HA   ALA   4           HA       ALA   4 -14.585   4.968  -0.180
   20    HB1  ALA   4           HB1      ALA   4 -15.431   5.539   2.474
   21    HB2  ALA   4           HB2      ALA   4 -15.443   6.594   1.060
   22    HB3  ALA   4           HB3      ALA   4 -16.843   5.582   1.417
   23    H    VAL   5           H        VAL   5 -15.835   2.902   2.443
   24    HA   VAL   5           HA       VAL   5 -13.444   2.602   3.847
   25    HB   VAL   5           HB       VAL   5 -15.365   1.870   4.967
   26   HG11  VAL   5          HG11      VAL   5 -16.744  -0.063   4.018
   27   HG12  VAL   5          HG12      VAL   5 -16.932   1.521   3.262
   28   HG13  VAL   5          HG13      VAL   5 -15.943   0.283   2.486
   29   HG21  VAL   5          HG21      VAL   5 -13.335   0.407   5.220
   30   HG22  VAL   5          HG22      VAL   5 -14.868  -0.357   5.641
   31   HG23  VAL   5          HG23      VAL   5 -14.097  -0.720   4.097
   32    H    PHE   6           H        PHE   6 -14.723   0.813   1.091
   33    HA   PHE   6           HA       PHE   6 -12.879  -1.293   1.070
   34    HB2  PHE   6           HB2      PHE   6 -14.552   0.014  -1.054
   35    HB3  PHE   6           HB3      PHE   6 -13.402  -1.250  -1.480
   36    HD1  PHE   6           HD1      PHE   6 -16.362  -0.508   0.613
   37    HD2  PHE   6           HD2      PHE   6 -13.920  -3.511  -1.157
   38    HE1  PHE   6           HE1      PHE   6 -18.023  -2.216   1.228
   39    HE2  PHE   6           HE2      PHE   6 -15.577  -5.223  -0.545
   40    HZ   PHE   6           HZ       PHE   6 -17.632  -4.577   0.648
   41    H    THR   7           H        THR   7 -12.825   1.743  -0.798
   42    HA   THR   7           HA       THR   7 -10.246   1.312  -1.884
   43    HB   THR   7           HB       THR   7 -11.931   2.873  -2.857
   44    HG1  THR   7           HG1      THR   7  -9.321   3.810  -2.235
   45   HG21  THR   7          HG21      THR   7 -11.149   4.570  -0.486
   46   HG22  THR   7          HG22      THR   7 -12.758   3.966  -0.884
   47   HG23  THR   7          HG23      THR   7 -11.995   5.183  -1.906
   48    H    ASP   8           H        ASP   8 -11.405   2.987   0.991
   49    HA   ASP   8           HA       ASP   8  -9.096   4.345   1.723
   50    HB2  ASP   8           HB2      ASP   8 -11.517   4.215   2.798
   51    HB3  ASP   8           HB3      ASP   8 -10.733   3.043   3.853
   52    H    ASN   9           H        ASN   9 -10.019   0.985   2.300
   53    HA   ASN   9           HA       ASN   9  -7.777   0.374   3.948
   54    HB2  ASN   9           HB2      ASN   9  -9.915  -1.200   2.579
   55    HB3  ASN   9           HB3      ASN   9  -8.480  -2.053   3.141
   56   HD21  ASN   9          HD21      ASN   9 -10.580   0.530   4.382
   57   HD22  ASN   9          HD22      ASN   9 -10.812  -0.178   5.940
   58    H    TYR  10           H        TYR  10  -8.440   0.162   0.502
   59    HA   TYR  10           HA       TYR  10  -6.162  -1.355  -0.204
   60    HB2  TYR  10           HB2      TYR  10  -7.657   0.641  -1.915
   61    HB3  TYR  10           HB3      TYR  10  -6.621  -0.662  -2.486
   62    HD1  TYR  10           HD1      TYR  10  -7.751  -2.629  -0.287
   63    HD2  TYR  10           HD2      TYR  10  -9.533  -0.155  -3.255
   64    HE1  TYR  10           HE1      TYR  10  -9.693  -4.137  -0.371
   65    HE2  TYR  10           HE2      TYR  10 -11.479  -1.656  -3.346
   66    HH   TYR  10           HH       TYR  10 -12.132  -3.858  -2.810
   67    H    THR  11           H        THR  11  -6.772   2.138  -0.125
   68    HA   THR  11           HA       THR  11  -4.334   3.001  -1.169
   69    HB   THR  11           HB       THR  11  -4.755   5.117   0.140
   70    HG1  THR  11           HG1      THR  11  -6.872   5.171   1.163
   71   HG21  THR  11          HG21      THR  11  -6.825   3.896  -1.658
   72   HG22  THR  11          HG22      THR  11  -5.625   5.134  -2.028
   73   HG23  THR  11          HG23      THR  11  -7.021   5.530  -1.025
   74    H    ARG  12           H        ARG  12  -5.259   2.289   2.179
   75    HA   ARG  12           HA       ARG  12  -2.740   3.036   3.286
   76    HB2  ARG  12           HB2      ARG  12  -3.574   1.856   5.321
   77    HB3  ARG  12           HB3      ARG  12  -4.682   3.072   4.700
   78    HG2  ARG  12           HG2      ARG  12  -5.998   1.298   3.624
   79    HG3  ARG  12           HG3      ARG  12  -4.904   0.095   4.311
   80    HD2  ARG  12           HD2      ARG  12  -5.522   1.357   6.555
   81    HD3  ARG  12           HD3      ARG  12  -6.968   1.773   5.636
   82    HE   ARG  12           HE       ARG  12  -7.638  -0.432   5.725
   83   HH11  ARG  12          HH12      ARG  12  -4.375  -0.121   6.898
   84   HH12  ARG  12          HH11      ARG  12  -4.314  -1.730   7.539
   85   HH21  ARG  12          HH22      ARG  12  -7.570  -2.551   6.565
   86   HH22  ARG  12          HH21      ARG  12  -6.131  -3.111   7.349
   87    H    LEU  13           H        LEU  13  -4.220  -0.062   2.400
   88    HA   LEU  13           HA       LEU  13  -2.194  -1.750   3.314
   89    HB2  LEU  13           HB2      LEU  13  -4.320  -2.632   2.651
   90    HB3  LEU  13           HB3      LEU  13  -4.105  -2.041   1.004
   91    HG   LEU  13           HG       LEU  13  -2.021  -3.666   1.068
   92   HD11  LEU  13          HD11      LEU  13  -3.086  -5.757   2.344
   93   HD12  LEU  13          HD12      LEU  13  -3.673  -4.461   3.386
   94   HD13  LEU  13          HD13      LEU  13  -1.943  -4.649   3.104
   95   HD21  LEU  13          HD21      LEU  13  -3.305  -4.453  -0.565
   96   HD22  LEU  13          HD22      LEU  13  -4.771  -3.876   0.228
   97   HD23  LEU  13          HD23      LEU  13  -4.111  -5.460   0.637
   98    H    ARG  14           H        ARG  14  -2.507   0.050   0.307
   99    HA   ARG  14           HA       ARG  14  -0.437  -1.146  -1.141
  100    HB2  ARG  14           HB2      ARG  14  -2.209   0.628  -1.850
  101    HB3  ARG  14           HB3      ARG  14  -1.000   1.794  -1.331
  102    HG2  ARG  14           HG2      ARG  14   0.551   0.316  -2.893
  103    HG3  ARG  14           HG3      ARG  14  -1.000  -0.034  -3.660
  104    HD2  ARG  14           HD2      ARG  14  -0.238   1.832  -4.820
  105    HD3  ARG  14           HD3      ARG  14  -1.344   2.517  -3.630
  106    HE   ARG  14           HE       ARG  14   1.320   2.455  -2.645
  107   HH11  ARG  14          HH12      ARG  14  -0.804   4.185  -4.793
  108   HH12  ARG  14          HH11      ARG  14   0.060   5.680  -4.655
  109   HH21  ARG  14          HH22      ARG  14   2.467   4.417  -2.455
  110   HH22  ARG  14          HH21      ARG  14   1.922   5.810  -3.325
  111    H    LYS  15           H        LYS  15  -0.389   1.388   1.297
  112    HA   LYS  15           HA       LYS  15   2.245   2.272   0.954
  113    HB2  LYS  15           HB2      LYS  15   0.461   3.339   2.383
  114    HB3  LYS  15           HB3      LYS  15   0.772   2.093   3.585
  115    HG2  LYS  15           HG2      LYS  15   1.924   4.442   3.733
  116    HG3  LYS  15           HG3      LYS  15   2.792   2.972   4.181
  117    HD2  LYS  15           HD2      LYS  15   4.007   2.948   2.173
  118    HD3  LYS  15           HD3      LYS  15   2.907   4.088   1.394
  119    HE2  LYS  15           HE2      LYS  15   5.094   5.078   2.052
  120    HE3  LYS  15           HE3      LYS  15   3.698   5.884   2.767
  121    HZ1  LYS  15           HZ1      LYS  15   4.795   5.631   4.676
  122    HZ2  LYS  15           HZ2      LYS  15   5.851   4.470   4.045
  123    HZ3  LYS  15           HZ3      LYS  15   4.325   4.007   4.609
  124    H    GLN  16           H        GLN  16   0.930  -0.349   2.945
  125    HA   GLN  16           HA       GLN  16   3.330  -1.068   4.214
  126    HB2  GLN  16           HB2      GLN  16   0.742  -2.466   3.668
  127    HB3  GLN  16           HB3      GLN  16   2.100  -3.391   4.294
  128    HG2  GLN  16           HG2      GLN  16   0.842  -0.982   5.587
  129    HG3  GLN  16           HG3      GLN  16   0.650  -2.661   6.089
  130   HE21  GLN  16          HE21      GLN  16   3.060  -3.703   6.125
  131   HE22  GLN  16          HE22      GLN  16   4.123  -2.847   7.183
  132    H    MET  17           H        MET  17   1.811  -2.287   1.243
  133    HA   MET  17           HA       MET  17   3.850  -4.185   0.684
  134    HB2  MET  17           HB2      MET  17   1.820  -2.907  -1.155
  135    HB3  MET  17           HB3      MET  17   2.816  -4.298  -1.561
  136    HG2  MET  17           HG2      MET  17   1.719  -5.259   0.647
  137    HG3  MET  17           HG3      MET  17   0.460  -4.102   0.222
  138    HE1  MET  17           HE1      MET  17  -1.505  -5.542  -2.409
  139    HE2  MET  17           HE2      MET  17  -1.072  -4.184  -1.370
  140    HE3  MET  17           HE3      MET  17  -0.318  -4.357  -2.956
  141    H    ALA  18           H        ALA  18   3.321  -0.827  -0.210
  142    HA   ALA  18           HA       ALA  18   5.430  -0.717  -2.133
  143    HB1  ALA  18           HB1      ALA  18   3.339   0.859  -1.707
  144    HB2  ALA  18           HB2      ALA  18   4.528   1.754  -0.760
  145    HB3  ALA  18           HB3      ALA  18   4.815   1.447  -2.473
  146    H    VAL  19           H        VAL  19   5.178  -0.153   1.316
  147    HA   VAL  19           HA       VAL  19   7.595   1.221   1.712
  148    HB   VAL  19           HB       VAL  19   5.790  -0.380   3.458
  149   HG11  VAL  19          HG11      VAL  19   8.643   0.292   4.093
  150   HG12  VAL  19          HG12      VAL  19   7.426   0.151   5.363
  151   HG13  VAL  19          HG13      VAL  19   7.784  -1.230   4.326
  152   HG21  VAL  19          HG21      VAL  19   5.348   1.630   4.468
  153   HG22  VAL  19          HG22      VAL  19   6.952   2.279   4.131
  154   HG23  VAL  19          HG23      VAL  19   5.754   2.177   2.841
  155    H    LYS  20           H        LYS  20   6.853  -2.252   1.860
  156    HA   LYS  20           HA       LYS  20   9.475  -3.083   2.506
  157    HB2  LYS  20           HB2      LYS  20   7.005  -4.412   1.499
  158    HB3  LYS  20           HB3      LYS  20   8.525  -5.284   1.349
  159    HG2  LYS  20           HG2      LYS  20   8.746  -5.572   3.593
  160    HG3  LYS  20           HG3      LYS  20   7.885  -4.080   3.982
  161    HD2  LYS  20           HD2      LYS  20   6.505  -6.478   2.801
  162    HD3  LYS  20           HD3      LYS  20   6.708  -6.266   4.542
  163    HE2  LYS  20           HE2      LYS  20   5.683  -3.892   4.018
  164    HE3  LYS  20           HE3      LYS  20   5.029  -4.737   2.616
  165    HZ1  LYS  20           HZ1      LYS  20   3.624  -4.684   4.715
  166    HZ2  LYS  20           HZ2      LYS  20   4.714  -5.811   5.351
  167    HZ3  LYS  20           HZ3      LYS  20   3.823  -6.187   3.963
  168    H    LYS  21           H        LYS  21   7.770  -2.721  -0.573
  169    HA   LYS  21           HA       LYS  21   9.812  -3.793  -2.204
  170    HB2  LYS  21           HB2      LYS  21   7.499  -1.943  -2.738
  171    HB3  LYS  21           HB3      LYS  21   8.632  -2.382  -4.008
  172    HG2  LYS  21           HG2      LYS  21   7.363  -4.551  -2.417
  173    HG3  LYS  21           HG3      LYS  21   6.406  -3.720  -3.645
  174    HD2  LYS  21           HD2      LYS  21   9.128  -4.839  -4.249
  175    HD3  LYS  21           HD3      LYS  21   7.672  -5.832  -4.351
  176    HE2  LYS  21           HE2      LYS  21   6.714  -4.207  -5.940
  177    HE3  LYS  21           HE3      LYS  21   8.213  -3.282  -5.871
  178    HZ1  LYS  21           HZ1      LYS  21   9.331  -5.409  -6.614
  179    HZ2  LYS  21           HZ2      LYS  21   8.388  -4.612  -7.769
  180    HZ3  LYS  21           HZ3      LYS  21   7.786  -5.987  -6.988
  181    H    TYR  22           H        TYR  22   9.178  -0.560  -0.976
  182    HA   TYR  22           HA       TYR  22  11.118   0.763  -2.579
  183    HB2  TYR  22           HB2      TYR  22   9.546   1.470  -0.133
  184    HB3  TYR  22           HB3      TYR  22  10.902   2.489  -0.602
  185    HD1  TYR  22           HD1      TYR  22   8.408   0.717  -2.732
  186    HD2  TYR  22           HD2      TYR  22   9.947   4.454  -1.403
  187    HE1  TYR  22           HE1      TYR  22   6.966   1.879  -4.350
  188    HE2  TYR  22           HE2      TYR  22   8.508   5.627  -3.016
  189    HH   TYR  22           HH       TYR  22   5.995   4.033  -4.737
  190    H    LEU  23           H        LEU  23  11.137  -0.222   0.848
  191    HA   LEU  23           HA       LEU  23  13.772   0.515   1.404
  192    HB2  LEU  23           HB2      LEU  23  13.621  -1.103   3.273
  193    HB3  LEU  23           HB3      LEU  23  12.260   0.013   3.182
  194    HG   LEU  23           HG       LEU  23  11.087  -1.944   1.925
  195   HD11  LEU  23          HD11      LEU  23  12.605  -3.786   3.616
  196   HD12  LEU  23          HD12      LEU  23  13.512  -3.143   2.247
  197   HD13  LEU  23          HD13      LEU  23  11.990  -3.990   1.975
  198   HD21  LEU  23          HD21      LEU  23  11.407  -1.288   4.740
  199   HD22  LEU  23          HD22      LEU  23  10.927  -2.965   4.480
  200   HD23  LEU  23          HD23      LEU  23   9.947  -1.654   3.821
  201    H    ASN  24           H        ASN  24  12.453  -2.398  -0.043
  202    HA   ASN  24           HA       ASN  24  14.846  -3.928   0.087
  203    HB2  ASN  24           HB2      ASN  24  12.682  -5.015  -0.187
  204    HB3  ASN  24           HB3      ASN  24  12.436  -4.192  -1.725
  205   HD21  ASN  24          HD21      ASN  24  13.132  -5.139  -3.521
  206   HD22  ASN  24          HD22      ASN  24  14.130  -6.549  -3.585
  207    H    SER  25           H        SER  25  13.485  -1.697  -2.258
  208    HA   SER  25           HA       SER  25  15.313  -2.285  -4.354
  209    HB2  SER  25           HB2      SER  25  13.195  -1.200  -4.846
  210    HB3  SER  25           HB3      SER  25  13.627   0.176  -3.831
  211    HG   SER  25           HG       SER  25  14.000   0.585  -6.056
  212    H    ILE  26           H        ILE  26  15.202   0.241  -1.863
  213    HA   ILE  26           HA       ILE  26  17.588   1.536  -2.690
  214    HB   ILE  26           HB       ILE  26  15.995   1.604  -0.143
  215   HG12  ILE  26          HG12      ILE  26  15.262   3.694  -0.876
  216   HG13  ILE  26          HG13      ILE  26  16.653   3.923  -1.929
  217   HG21  ILE  26          HG21      ILE  26  18.080   1.971   0.775
  218   HG22  ILE  26          HG22      ILE  26  18.701   2.746  -0.681
  219   HG23  ILE  26          HG23      ILE  26  17.574   3.610   0.365
  220   HD11  ILE  26          HD11      ILE  26  15.781   2.394  -3.530
  221   HD12  ILE  26          HD12      ILE  26  14.489   1.901  -2.435
  222   HD13  ILE  26          HD13      ILE  26  14.500   3.531  -3.108
  223    H    LEU  27           H        LEU  27  16.898  -1.131  -0.536
  224    HA   LEU  27           HA       LEU  27  19.549  -1.192   0.592
  225    HB2  LEU  27           HB2      LEU  27  17.292  -3.188   0.702
  226    HB3  LEU  27           HB3      LEU  27  18.795  -3.313   1.614
  227    HG   LEU  27           HG       LEU  27  17.077  -0.894   1.953
  228   HD11  LEU  27          HD11      LEU  27  15.412  -1.942   2.985
  229   HD12  LEU  27          HD12      LEU  27  16.524  -2.950   3.910
  230   HD13  LEU  27          HD13      LEU  27  16.031  -3.440   2.290
  231   HD21  LEU  27          HD21      LEU  27  19.465  -1.518   2.965
  232   HD22  LEU  27          HD22      LEU  27  18.444  -2.307   4.167
  233   HD23  LEU  27          HD23      LEU  27  18.268  -0.579   3.858
  234    H    ASN  28           H        ASN  28  17.736  -3.033  -1.827
  235    HA   ASN  28           HA       ASN  28  20.001  -4.745  -2.390
  236    HB2  ASN  28           HB2      ASN  28  18.557  -6.036  -3.632
  237    HB3  ASN  28           HB3      ASN  28  17.408  -5.267  -2.541
  238   HD21  ASN  28          HD21      ASN  28  15.641  -4.685  -3.551
  239   HD22  ASN  28          HD22      ASN  28  15.541  -4.042  -5.151
  240    H    GLY  29           H        GLY  29  18.728  -1.758  -3.506
  241    HA2  GLY  29           HA2      GLY  29  20.440  -0.468  -4.804
  242    HA3  GLY  29           HA3      GLY  29  20.514  -1.873  -5.857
  Start of MODEL   12
    1    H1   HIS   1           H        HIS   1 -23.433   4.152  -1.724
    2    HA   HIS   1           HA       HIS   1 -22.602   6.768  -1.550
    3    HB2  HIS   1           HB2      HIS   1 -24.738   5.711  -0.632
    4    HB3  HIS   1           HB3      HIS   1 -23.794   5.291   0.794
    5    HD1  HIS   1           HD1      HIS   1 -23.652   8.572  -1.094
    6    HD2  HIS   1           HD2      HIS   1 -24.832   7.062   2.593
    7    HE1  HIS   1           HE1      HIS   1 -24.229  10.582   0.303
    8    HE2  HIS   1           HE2      HIS   1 -24.858   9.649   2.556
    9    H    SER   2           H        SER   2 -21.776   4.130   0.698
   10    HA   SER   2           HA       SER   2 -19.579   5.796   1.726
   11    HB2  SER   2           HB2      SER   2 -20.991   3.419   2.958
   12    HB3  SER   2           HB3      SER   2 -19.589   4.217   3.669
   13    HG   SER   2           HG       SER   2 -22.155   5.320   3.190
   14    H    ASP   3           H        ASP   3 -18.102   5.336   0.075
   15    HA   ASP   3           HA       ASP   3 -17.102   2.562   0.059
   16    HB2  ASP   3           HB2      ASP   3 -17.473   4.533  -2.158
   17    HB3  ASP   3           HB3      ASP   3 -16.142   3.383  -2.261
   18    H    ALA   4           H        ALA   4 -16.431   5.804   0.755
   19    HA   ALA   4           HA       ALA   4 -13.761   6.156   0.203
   20    HB1  ALA   4           HB1      ALA   4 -15.672   7.269   2.084
   21    HB2  ALA   4           HB2      ALA   4 -14.025   7.267   2.717
   22    HB3  ALA   4           HB3      ALA   4 -14.379   8.060   1.182
   23    H    VAL   5           H        VAL   5 -15.168   4.582   3.067
   24    HA   VAL   5           HA       VAL   5 -12.736   3.968   4.334
   25    HB   VAL   5           HB       VAL   5 -14.878   3.871   5.512
   26   HG11  VAL   5          HG11      VAL   5 -16.600   2.452   5.015
   27   HG12  VAL   5          HG12      VAL   5 -15.939   2.697   3.397
   28   HG13  VAL   5          HG13      VAL   5 -15.540   1.236   4.302
   29   HG21  VAL   5          HG21      VAL   5 -14.422   1.970   6.852
   30   HG22  VAL   5          HG22      VAL   5 -13.646   1.124   5.514
   31   HG23  VAL   5          HG23      VAL   5 -12.866   2.530   6.238
   32    H    PHE   6           H        PHE   6 -14.658   2.214   1.952
   33    HA   PHE   6           HA       PHE   6 -13.264  -0.223   2.048
   34    HB2  PHE   6           HB2      PHE   6 -14.957   1.126  -0.032
   35    HB3  PHE   6           HB3      PHE   6 -14.120  -0.376  -0.409
   36    HD1  PHE   6           HD1      PHE   6 -16.667   1.173   1.752
   37    HD2  PHE   6           HD2      PHE   6 -14.886  -2.458   0.424
   38    HE1  PHE   6           HE1      PHE   6 -18.499  -0.102   2.789
   39    HE2  PHE   6           HE2      PHE   6 -16.715  -3.738   1.458
   40    HZ   PHE   6           HZ       PHE   6 -18.525  -2.560   2.642
   41    H    THR   7           H        THR   7 -12.914   2.501  -0.224
   42    HA   THR   7           HA       THR   7 -10.649   1.440  -1.543
   43    HB   THR   7           HB       THR   7 -12.039   3.157  -2.589
   44    HG1  THR   7           HG1      THR   7  -9.569   2.973  -2.844
   45   HG21  THR   7          HG21      THR   7 -12.087   5.427  -1.853
   46   HG22  THR   7          HG22      THR   7 -10.856   5.119  -0.628
   47   HG23  THR   7          HG23      THR   7 -12.466   4.422  -0.455
   48    H    ASP   8           H        ASP   8 -11.024   3.666   1.173
   49    HA   ASP   8           HA       ASP   8  -8.393   4.525   1.435
   50    HB2  ASP   8           HB2      ASP   8  -9.816   5.675   2.834
   51    HB3  ASP   8           HB3      ASP   8 -10.692   4.223   3.311
   52    H    ASN   9           H        ASN   9  -9.919   1.539   2.486
   53    HA   ASN   9           HA       ASN   9  -7.725   0.634   4.064
   54    HB2  ASN   9           HB2      ASN   9 -10.250  -0.129   4.013
   55    HB3  ASN   9           HB3      ASN   9  -9.660  -1.274   2.811
   56   HD21  ASN   9          HD21      ASN   9 -10.102  -0.685   6.064
   57   HD22  ASN   9          HD22      ASN   9  -9.119  -1.956   6.699
   58    H    TYR  10           H        TYR  10  -8.811  -0.014   0.752
   59    HA   TYR  10           HA       TYR  10  -6.861  -1.934   0.115
   60    HB2  TYR  10           HB2      TYR  10  -8.219   0.011  -1.762
   61    HB3  TYR  10           HB3      TYR  10  -7.437  -1.500  -2.213
   62    HD1  TYR  10           HD1      TYR  10  -8.487  -3.216   0.041
   63    HD2  TYR  10           HD2      TYR  10 -10.420  -0.405  -2.502
   64    HE1  TYR  10           HE1      TYR  10 -10.614  -4.411   0.348
   65    HE2  TYR  10           HE2      TYR  10 -12.553  -1.592  -2.202
   66    HH   TYR  10           HH       TYR  10 -13.031  -3.937   0.191
   67    H    THR  11           H        THR  11  -6.916   1.582  -0.370
   68    HA   THR  11           HA       THR  11  -4.409   1.761  -1.651
   69    HB   THR  11           HB       THR  11  -6.139   3.562  -1.673
   70    HG1  THR  11           HG1      THR  11  -4.139   4.216  -2.330
   71   HG21  THR  11          HG21      THR  11  -6.748   3.522   0.692
   72   HG22  THR  11          HG22      THR  11  -6.209   5.133   0.215
   73   HG23  THR  11          HG23      THR  11  -5.132   4.076   1.128
   74    H    ARG  12           H        ARG  12  -5.369   1.996   1.745
   75    HA   ARG  12           HA       ARG  12  -2.849   2.755   2.758
   76    HB2  ARG  12           HB2      ARG  12  -4.976   2.958   4.014
   77    HB3  ARG  12           HB3      ARG  12  -5.039   1.207   4.153
   78    HG2  ARG  12           HG2      ARG  12  -3.060   1.182   5.506
   79    HG3  ARG  12           HG3      ARG  12  -2.812   2.910   5.246
   80    HD2  ARG  12           HD2      ARG  12  -5.401   2.017   6.404
   81    HD3  ARG  12           HD3      ARG  12  -3.971   1.978   7.435
   82    HE   ARG  12           HE       ARG  12  -5.370   4.309   6.492
   83   HH11  ARG  12          HH12      ARG  12  -2.350   3.062   7.694
   84   HH12  ARG  12          HH11      ARG  12  -1.798   4.597   8.277
   85   HH21  ARG  12          HH22      ARG  12  -4.655   6.336   7.256
   86   HH22  ARG  12          HH21      ARG  12  -3.110   6.458   8.028
   87    H    LEU  13           H        LEU  13  -4.354  -0.403   2.242
   88    HA   LEU  13           HA       LEU  13  -2.322  -1.940   3.459
   89    HB2  LEU  13           HB2      LEU  13  -4.537  -2.834   3.028
   90    HB3  LEU  13           HB3      LEU  13  -4.287  -2.667   1.291
   91    HG   LEU  13           HG       LEU  13  -2.275  -4.298   1.751
   92   HD11  LEU  13          HD11      LEU  13  -2.467  -4.337   4.157
   93   HD12  LEU  13          HD12      LEU  13  -2.847  -5.931   3.506
   94   HD13  LEU  13          HD13      LEU  13  -4.146  -4.866   4.045
   95   HD21  LEU  13          HD21      LEU  13  -4.221  -6.168   1.704
   96   HD22  LEU  13          HD22      LEU  13  -3.719  -5.230   0.296
   97   HD23  LEU  13          HD23      LEU  13  -5.137  -4.739   1.224
   98    H    ARG  14           H        ARG  14  -2.803  -0.790   0.159
   99    HA   ARG  14           HA       ARG  14  -0.755  -2.250  -1.079
  100    HB2  ARG  14           HB2      ARG  14  -2.644  -0.657  -2.033
  101    HB3  ARG  14           HB3      ARG  14  -1.350   0.533  -1.976
  102    HG2  ARG  14           HG2      ARG  14   0.042  -0.981  -3.354
  103    HG3  ARG  14           HG3      ARG  14  -1.341  -2.070  -3.486
  104    HD2  ARG  14           HD2      ARG  14  -1.708   0.792  -4.213
  105    HD3  ARG  14           HD3      ARG  14  -0.833  -0.253  -5.331
  106    HE   ARG  14           HE       ARG  14  -3.655  -0.335  -4.710
  107   HH11  ARG  14          HH12      ARG  14  -0.925  -2.014  -6.068
  108   HH12  ARG  14          HH11      ARG  14  -1.893  -3.079  -7.032
  109   HH21  ARG  14          HH22      ARG  14  -4.941  -1.731  -5.975
  110   HH22  ARG  14          HH21      ARG  14  -4.178  -2.916  -6.979
  111    H    LYS  15           H        LYS  15  -0.716   0.805   0.672
  112    HA   LYS  15           HA       LYS  15   1.874   1.639   0.008
  113    HB2  LYS  15           HB2      LYS  15   0.344   3.156   1.086
  114    HB3  LYS  15           HB3      LYS  15   0.225   2.111   2.495
  115    HG2  LYS  15           HG2      LYS  15   1.654   3.757   3.229
  116    HG3  LYS  15           HG3      LYS  15   2.779   2.508   2.692
  117    HD2  LYS  15           HD2      LYS  15   1.920   4.557   0.717
  118    HD3  LYS  15           HD3      LYS  15   3.058   5.045   1.976
  119    HE2  LYS  15           HE2      LYS  15   4.724   3.698   1.182
  120    HE3  LYS  15           HE3      LYS  15   3.600   2.516   0.513
  121    HZ1  LYS  15           HZ1      LYS  15   3.853   5.216  -0.657
  122    HZ2  LYS  15           HZ2      LYS  15   3.244   3.808  -1.369
  123    HZ3  LYS  15           HZ3      LYS  15   4.907   3.969  -1.102
  124    H    GLN  16           H        GLN  16   0.703  -0.536   2.526
  125    HA   GLN  16           HA       GLN  16   3.159  -0.818   3.896
  126    HB2  GLN  16           HB2      GLN  16   0.633  -2.429   3.766
  127    HB3  GLN  16           HB3      GLN  16   2.040  -3.064   4.609
  128    HG2  GLN  16           HG2      GLN  16   1.111  -0.315   5.255
  129    HG3  GLN  16           HG3      GLN  16   0.196  -1.691   5.869
  130   HE21  GLN  16          HE21      GLN  16   3.279  -0.053   5.902
  131   HE22  GLN  16          HE22      GLN  16   3.874  -0.786   7.349
  132    H    MET  17           H        MET  17   1.615  -2.762   1.355
  133    HA   MET  17           HA       MET  17   3.712  -4.674   1.200
  134    HB2  MET  17           HB2      MET  17   1.774  -4.002  -1.009
  135    HB3  MET  17           HB3      MET  17   2.585  -5.534  -0.712
  136    HG2  MET  17           HG2      MET  17   0.791  -4.471   1.398
  137    HG3  MET  17           HG3      MET  17   0.062  -5.136  -0.062
  138    HE1  MET  17           HE1      MET  17   1.214  -8.815  -0.068
  139    HE2  MET  17           HE2      MET  17   0.442  -7.493  -0.943
  140    HE3  MET  17           HE3      MET  17   2.199  -7.543  -0.792
  141    H    ALA  18           H        ALA  18   3.030  -1.647  -0.452
  142    HA   ALA  18           HA       ALA  18   5.075  -1.936  -2.423
  143    HB1  ALA  18           HB1      ALA  18   4.334   0.031  -3.260
  144    HB2  ALA  18           HB2      ALA  18   2.939  -0.334  -2.244
  145    HB3  ALA  18           HB3      ALA  18   4.181   0.778  -1.669
  146    H    VAL  19           H        VAL  19   4.974  -0.802   0.853
  147    HA   VAL  19           HA       VAL  19   7.258   0.828   0.882
  148    HB   VAL  19           HB       VAL  19   5.718  -0.658   2.948
  149   HG11  VAL  19          HG11      VAL  19   7.868  -1.234   3.722
  150   HG12  VAL  19          HG12      VAL  19   8.524   0.356   3.327
  151   HG13  VAL  19          HG13      VAL  19   7.390   0.176   4.667
  152   HG21  VAL  19          HG21      VAL  19   5.941   1.997   1.993
  153   HG22  VAL  19          HG22      VAL  19   4.886   1.377   3.263
  154   HG23  VAL  19          HG23      VAL  19   6.490   1.988   3.669
  155    H    LYS  20           H        LYS  20   6.867  -2.659   1.266
  156    HA   LYS  20           HA       LYS  20   9.450  -3.309   2.090
  157    HB2  LYS  20           HB2      LYS  20   7.434  -4.843   0.453
  158    HB3  LYS  20           HB3      LYS  20   8.962  -5.542   0.973
  159    HG2  LYS  20           HG2      LYS  20   7.754  -6.237   2.728
  160    HG3  LYS  20           HG3      LYS  20   8.036  -4.599   3.324
  161    HD2  LYS  20           HD2      LYS  20   5.861  -4.110   1.882
  162    HD3  LYS  20           HD3      LYS  20   5.571  -5.822   2.201
  163    HE2  LYS  20           HE2      LYS  20   5.863  -3.571   4.169
  164    HE3  LYS  20           HE3      LYS  20   4.500  -4.668   3.950
  165    HZ1  LYS  20           HZ1      LYS  20   6.505  -4.940   5.777
  166    HZ2  LYS  20           HZ2      LYS  20   6.924  -6.051   4.574
  167    HZ3  LYS  20           HZ3      LYS  20   5.409  -6.145   5.320
  168    H    LYS  21           H        LYS  21   8.122  -3.006  -1.188
  169    HA   LYS  21           HA       LYS  21  10.475  -3.735  -2.557
  170    HB2  LYS  21           HB2      LYS  21   7.934  -2.362  -3.264
  171    HB3  LYS  21           HB3      LYS  21   9.288  -2.164  -4.368
  172    HG2  LYS  21           HG2      LYS  21   8.566  -4.904  -3.456
  173    HG3  LYS  21           HG3      LYS  21   7.568  -4.111  -4.678
  174    HD2  LYS  21           HD2      LYS  21   9.528  -3.784  -6.087
  175    HD3  LYS  21           HD3      LYS  21  10.554  -4.522  -4.855
  176    HE2  LYS  21           HE2      LYS  21  10.079  -6.146  -6.569
  177    HE3  LYS  21           HE3      LYS  21   9.254  -6.613  -5.082
  178    HZ1  LYS  21           HZ1      LYS  21   7.697  -4.959  -6.873
  179    HZ2  LYS  21           HZ2      LYS  21   7.250  -6.346  -6.016
  180    HZ3  LYS  21           HZ3      LYS  21   8.079  -6.490  -7.483
  181    H    TYR  22           H        TYR  22   9.295  -0.655  -1.335
  182    HA   TYR  22           HA       TYR  22  11.132   1.028  -2.628
  183    HB2  TYR  22           HB2      TYR  22   9.454   1.249  -0.161
  184    HB3  TYR  22           HB3      TYR  22  10.685   2.469  -0.467
  185    HD1  TYR  22           HD1      TYR  22   8.331   0.671  -2.747
  186    HD2  TYR  22           HD2      TYR  22   9.639   4.404  -1.177
  187    HE1  TYR  22           HE1      TYR  22   6.785   1.842  -4.259
  188    HE2  TYR  22           HE2      TYR  22   8.096   5.585  -2.685
  189    HH   TYR  22           HH       TYR  22   6.498   4.022  -5.271
  190    H    LEU  23           H        LEU  23  11.250  -0.429   0.620
  191    HA   LEU  23           HA       LEU  23  13.856   0.551   1.203
  192    HB2  LEU  23           HB2      LEU  23  12.597  -1.852   2.483
  193    HB3  LEU  23           HB3      LEU  23  13.737  -0.705   3.185
  194    HG   LEU  23           HG       LEU  23  10.925   0.055   2.429
  195   HD11  LEU  23          HD11      LEU  23  10.448  -0.165   4.874
  196   HD12  LEU  23          HD12      LEU  23  11.970  -1.041   5.031
  197   HD13  LEU  23          HD13      LEU  23  10.677  -1.695   4.026
  198   HD21  LEU  23          HD21      LEU  23  11.464   2.084   3.162
  199   HD22  LEU  23          HD22      LEU  23  13.146   1.553   3.159
  200   HD23  LEU  23          HD23      LEU  23  12.186   1.435   4.635
  201    H    ASN  24           H        ASN  24  12.605  -2.377  -0.254
  202    HA   ASN  24           HA       ASN  24  14.916  -3.964  -0.083
  203    HB2  ASN  24           HB2      ASN  24  12.512  -4.606  -0.807
  204    HB3  ASN  24           HB3      ASN  24  13.019  -4.094  -2.414
  205   HD21  ASN  24          HD21      ASN  24  15.111  -5.080  -3.164
  206   HD22  ASN  24          HD22      ASN  24  15.345  -6.758  -2.825
  207    H    SER  25           H        SER  25  13.808  -1.720  -2.598
  208    HA   SER  25           HA       SER  25  16.014  -2.175  -4.333
  209    HB2  SER  25           HB2      SER  25  13.842  -0.115  -4.165
  210    HB3  SER  25           HB3      SER  25  15.206   0.148  -5.251
  211    HG   SER  25           HG       SER  25  14.197  -1.120  -6.573
  212    H    ILE  26           H        ILE  26  15.225   0.507  -2.125
  213    HA   ILE  26           HA       ILE  26  17.590   1.960  -2.512
  214    HB   ILE  26           HB       ILE  26  15.633   1.855  -0.234
  215   HG12  ILE  26          HG12      ILE  26  14.788   3.833  -1.106
  216   HG13  ILE  26          HG13      ILE  26  16.307   4.258  -1.887
  217   HG21  ILE  26          HG21      ILE  26  17.506   2.425   0.985
  218   HG22  ILE  26          HG22      ILE  26  18.262   3.264  -0.369
  219   HG23  ILE  26          HG23      ILE  26  16.909   4.007   0.484
  220   HD11  ILE  26          HD11      ILE  26  15.928   2.548  -3.573
  221   HD12  ILE  26          HD12      ILE  26  14.417   2.095  -2.783
  222   HD13  ILE  26          HD13      ILE  26  14.588   3.692  -3.510
  223    H    LEU  27           H        LEU  27  16.739  -0.262   0.147
  224    HA   LEU  27           HA       LEU  27  19.248  -0.207   1.400
  225    HB2  LEU  27           HB2      LEU  27  17.229  -2.445   1.383
  226    HB3  LEU  27           HB3      LEU  27  18.531  -2.228   2.551
  227    HG   LEU  27           HG       LEU  27  16.357  -0.182   2.215
  228   HD11  LEU  27          HD11      LEU  27  16.330  -2.698   3.859
  229   HD12  LEU  27          HD12      LEU  27  15.126  -2.134   2.701
  230   HD13  LEU  27          HD13      LEU  27  15.330  -1.295   4.239
  231   HD21  LEU  27          HD21      LEU  27  17.552  -0.681   4.832
  232   HD22  LEU  27          HD22      LEU  27  17.295   0.837   3.971
  233   HD23  LEU  27          HD23      LEU  27  18.712  -0.152   3.613
  234    H    ASN  28           H        ASN  28  17.986  -2.166  -1.225
  235    HA   ASN  28           HA       ASN  28  19.934  -4.157  -1.314
  236    HB2  ASN  28           HB2      ASN  28  18.129  -4.565  -2.715
  237    HB3  ASN  28           HB3      ASN  28  18.124  -2.926  -3.357
  238   HD21  ASN  28          HD21      ASN  28  20.202  -5.796  -3.232
  239   HD22  ASN  28          HD22      ASN  28  20.770  -5.666  -4.858
  240    H    GLY  29           H        GLY  29  19.998  -0.844  -2.452
  241    HA2  GLY  29           HA2      GLY  29  22.287  -1.040  -4.099
  242    HA3  GLY  29           HA3      GLY  29  21.672   0.434  -3.367
  Start of MODEL   13
    1    H1   HIS   1           H        HIS   1 -21.968   0.600   4.915
    2    HA   HIS   1           HA       HIS   1 -22.629   0.333   2.521
    3    HB2  HIS   1           HB2      HIS   1 -24.212   1.238   4.325
    4    HB3  HIS   1           HB3      HIS   1 -23.873   2.832   3.657
    5    HD1  HIS   1           HD1      HIS   1 -24.669  -0.461   1.916
    6    HD2  HIS   1           HD2      HIS   1 -26.033   3.455   2.162
    7    HE1  HIS   1           HE1      HIS   1 -26.563  -0.304   0.268
    8    HE2  HIS   1           HE2      HIS   1 -27.316   2.097   0.373
    9    H    SER   2           H        SER   2 -20.119   1.481   2.250
   10    HA   SER   2           HA       SER   2 -20.529   3.124  -0.052
   11    HB2  SER   2           HB2      SER   2 -19.706   4.367   2.527
   12    HB3  SER   2           HB3      SER   2 -18.887   4.914   1.064
   13    HG   SER   2           HG       SER   2 -20.691   5.803   0.365
   14    H    ASP   3           H        ASP   3 -18.907   2.822  -1.456
   15    HA   ASP   3           HA       ASP   3 -16.892   0.940  -0.974
   16    HB2  ASP   3           HB2      ASP   3 -17.669   1.375  -3.224
   17    HB3  ASP   3           HB3      ASP   3 -17.116   3.045  -3.133
   18    H    ALA   4           H        ALA   4 -17.085   4.134   0.027
   19    HA   ALA   4           HA       ALA   4 -14.548   5.178  -0.206
   20    HB1  ALA   4           HB1      ALA   4 -16.829   5.587   1.549
   21    HB2  ALA   4           HB2      ALA   4 -15.289   5.926   2.341
   22    HB3  ALA   4           HB3      ALA   4 -15.714   6.760   0.846
   23    H    VAL   5           H        VAL   5 -15.762   3.088   2.413
   24    HA   VAL   5           HA       VAL   5 -13.335   2.917   3.824
   25    HB   VAL   5           HB       VAL   5 -15.492   2.282   4.812
   26   HG11  VAL   5          HG11      VAL   5 -16.437   0.042   4.274
   27   HG12  VAL   5          HG12      VAL   5 -16.560   1.206   2.953
   28   HG13  VAL   5          HG13      VAL   5 -15.322  -0.051   2.912
   29   HG21  VAL   5          HG21      VAL   5 -13.479   1.461   5.861
   30   HG22  VAL   5          HG22      VAL   5 -14.729   0.220   5.948
   31   HG23  VAL   5          HG23      VAL   5 -13.430   0.081   4.763
   32    H    PHE   6           H        PHE   6 -14.692   0.955   1.223
   33    HA   PHE   6           HA       PHE   6 -12.806  -1.123   1.280
   34    HB2  PHE   6           HB2      PHE   6 -14.616  -0.025  -0.851
   35    HB3  PHE   6           HB3      PHE   6 -13.465  -1.303  -1.228
   36    HD1  PHE   6           HD1      PHE   6 -16.415  -0.426   0.794
   37    HD2  PHE   6           HD2      PHE   6 -13.837  -3.540  -0.539
   38    HE1  PHE   6           HE1      PHE   6 -18.008  -2.102   1.635
   39    HE2  PHE   6           HE2      PHE   6 -15.427  -5.220   0.299
   40    HZ   PHE   6           HZ       PHE   6 -17.516  -4.502   1.387
   41    H    THR   7           H        THR   7 -12.928   1.762  -0.810
   42    HA   THR   7           HA       THR   7 -10.400   1.300  -2.002
   43    HB   THR   7           HB       THR   7 -12.109   2.721  -3.060
   44    HG1  THR   7           HG1      THR   7  -9.752   4.209  -2.461
   45   HG21  THR   7          HG21      THR   7 -11.482   4.617  -0.794
   46   HG22  THR   7          HG22      THR   7 -13.029   3.840  -1.130
   47   HG23  THR   7          HG23      THR   7 -12.391   5.052  -2.240
   48    H    ASP   8           H        ASP   8 -11.454   3.198   0.778
   49    HA   ASP   8           HA       ASP   8  -9.098   4.614   1.264
   50    HB2  ASP   8           HB2      ASP   8 -10.804   5.386   2.589
   51    HB3  ASP   8           HB3      ASP   8 -11.432   3.771   2.908
   52    H    ASN   9           H        ASN   9 -10.031   1.335   2.136
   53    HA   ASN   9           HA       ASN   9  -7.799   0.855   3.844
   54    HB2  ASN   9           HB2      ASN   9  -9.870  -0.450   4.031
   55    HB3  ASN   9           HB3      ASN   9  -9.612  -1.102   2.415
   56   HD21  ASN   9          HD21      ASN   9  -9.720  -2.244   5.231
   57   HD22  ASN   9          HD22      ASN   9  -8.320  -3.254   5.318
   58    H    TYR  10           H        TYR  10  -8.432   0.442   0.421
   59    HA   TYR  10           HA       TYR  10  -6.214  -1.193  -0.186
   60    HB2  TYR  10           HB2      TYR  10  -7.630   0.794  -1.975
   61    HB3  TYR  10           HB3      TYR  10  -6.589  -0.521  -2.509
   62    HD1  TYR  10           HD1      TYR  10  -7.721  -2.497  -0.360
   63    HD2  TYR  10           HD2      TYR  10  -9.524   0.028  -3.272
   64    HE1  TYR  10           HE1      TYR  10  -9.665  -4.001  -0.452
   65    HE2  TYR  10           HE2      TYR  10 -11.474  -1.469  -3.371
   66    HH   TYR  10           HH       TYR  10 -11.799  -4.210  -1.182
   67    H    THR  11           H        THR  11  -6.608   2.280   0.113
   68    HA   THR  11           HA       THR  11  -4.155   3.045  -1.059
   69    HB   THR  11           HB       THR  11  -4.475   5.199  -0.019
   70    HG1  THR  11           HG1      THR  11  -6.682   4.205   1.445
   71   HG21  THR  11          HG21      THR  11  -5.960   5.377  -1.697
   72   HG22  THR  11          HG22      THR  11  -7.181   5.227  -0.433
   73   HG23  THR  11          HG23      THR  11  -6.680   3.806  -1.348
   74    H    ARG  12           H        ARG  12  -5.080   2.353   2.294
   75    HA   ARG  12           HA       ARG  12  -2.501   2.944   3.366
   76    HB2  ARG  12           HB2      ARG  12  -3.376   1.857   5.422
   77    HB3  ARG  12           HB3      ARG  12  -4.440   3.107   4.792
   78    HG2  ARG  12           HG2      ARG  12  -5.851   1.378   3.773
   79    HG3  ARG  12           HG3      ARG  12  -4.794   0.137   4.450
   80    HD2  ARG  12           HD2      ARG  12  -5.924   2.169   6.299
   81    HD3  ARG  12           HD3      ARG  12  -7.009   0.927   5.677
   82    HE   ARG  12           HE       ARG  12  -5.025   0.594   7.671
   83   HH11  ARG  12          HH12      ARG  12  -6.509  -1.023   4.969
   84   HH12  ARG  12          HH11      ARG  12  -6.200  -2.613   5.583
   85   HH21  ARG  12          HH22      ARG  12  -4.613  -1.494   8.491
   86   HH22  ARG  12          HH21      ARG  12  -5.122  -2.880   7.587
   87    H    LEU  13           H        LEU  13  -4.201  -0.049   2.511
   88    HA   LEU  13           HA       LEU  13  -2.287  -1.872   3.402
   89    HB2  LEU  13           HB2      LEU  13  -4.523  -2.530   2.717
   90    HB3  LEU  13           HB3      LEU  13  -4.166  -2.073   1.052
   91    HG   LEU  13           HG       LEU  13  -2.303  -3.878   1.232
   92   HD11  LEU  13          HD11      LEU  13  -2.168  -4.916   3.189
   93   HD12  LEU  13          HD12      LEU  13  -3.733  -5.647   2.836
   94   HD13  LEU  13          HD13      LEU  13  -3.649  -4.152   3.767
   95   HD21  LEU  13          HD21      LEU  13  -4.077  -4.159  -0.301
   96   HD22  LEU  13          HD22      LEU  13  -5.252  -4.419   0.989
   97   HD23  LEU  13          HD23      LEU  13  -4.024  -5.641   0.655
   98    H    ARG  14           H        ARG  14  -2.534  -0.111   0.355
   99    HA   ARG  14           HA       ARG  14  -0.524  -1.436  -1.065
  100    HB2  ARG  14           HB2      ARG  14  -2.239   0.464  -1.744
  101    HB3  ARG  14           HB3      ARG  14  -0.868   1.509  -1.396
  102    HG2  ARG  14           HG2      ARG  14   0.477   0.112  -2.986
  103    HG3  ARG  14           HG3      ARG  14  -1.030  -0.688  -3.440
  104    HD2  ARG  14           HD2      ARG  14  -1.878   1.752  -3.810
  105    HD3  ARG  14           HD3      ARG  14  -0.159   2.131  -3.907
  106    HE   ARG  14           HE       ARG  14  -0.436   0.052  -5.617
  107   HH11  ARG  14          HH12      ARG  14  -2.076   3.103  -5.263
  108   HH12  ARG  14          HH11      ARG  14  -2.440   3.251  -6.950
  109   HH21  ARG  14          HH22      ARG  14  -0.909   0.236  -7.841
  110   HH22  ARG  14          HH21      ARG  14  -1.777   1.620  -8.416
  111    H    LYS  15           H        LYS  15  -0.356   1.226   1.242
  112    HA   LYS  15           HA       LYS  15   2.306   1.971   0.874
  113    HB2  LYS  15           HB2      LYS  15   0.510   3.095   2.305
  114    HB3  LYS  15           HB3      LYS  15   0.932   1.933   3.556
  115    HG2  LYS  15           HG2      LYS  15   2.114   3.934   4.017
  116    HG3  LYS  15           HG3      LYS  15   3.287   2.762   3.413
  117    HD2  LYS  15           HD2      LYS  15   2.605   3.922   1.098
  118    HD3  LYS  15           HD3      LYS  15   2.301   5.273   2.192
  119    HE2  LYS  15           HE2      LYS  15   4.621   5.146   1.195
  120    HE3  LYS  15           HE3      LYS  15   4.537   5.288   2.951
  121    HZ1  LYS  15           HZ1      LYS  15   5.999   3.460   1.657
  122    HZ2  LYS  15           HZ2      LYS  15   4.586   2.576   1.943
  123    HZ3  LYS  15           HZ3      LYS  15   5.428   3.266   3.238
  124    H    GLN  16           H        GLN  16   0.909  -0.508   2.992
  125    HA   GLN  16           HA       GLN  16   3.265  -1.283   4.281
  126    HB2  GLN  16           HB2      GLN  16   0.637  -2.593   3.743
  127    HB3  GLN  16           HB3      GLN  16   1.957  -3.581   4.354
  128    HG2  GLN  16           HG2      GLN  16   0.813  -1.127   5.667
  129    HG3  GLN  16           HG3      GLN  16   0.558  -2.799   6.165
  130   HE21  GLN  16          HE21      GLN  16   2.531  -4.019   6.744
  131   HE22  GLN  16          HE22      GLN  16   3.789  -3.178   7.575
  132    H    MET  17           H        MET  17   1.765  -2.524   1.311
  133    HA   MET  17           HA       MET  17   3.761  -4.487   0.826
  134    HB2  MET  17           HB2      MET  17   1.805  -3.192  -1.081
  135    HB3  MET  17           HB3      MET  17   2.762  -4.625  -1.430
  136    HG2  MET  17           HG2      MET  17   1.605  -5.536   0.740
  137    HG3  MET  17           HG3      MET  17   0.407  -4.303   0.353
  138    HE1  MET  17           HE1      MET  17   2.685  -6.820  -1.297
  139    HE2  MET  17           HE2      MET  17   1.580  -8.048  -0.680
  140    HE3  MET  17           HE3      MET  17   1.667  -7.730  -2.413
  141    H    ALA  18           H        ALA  18   3.335  -1.136  -0.152
  142    HA   ALA  18           HA       ALA  18   5.482  -1.123  -2.035
  143    HB1  ALA  18           HB1      ALA  18   4.978   1.493  -1.015
  144    HB2  ALA  18           HB2      ALA  18   4.564   0.818  -2.591
  145    HB3  ALA  18           HB3      ALA  18   3.442   0.656  -1.240
  146    H    VAL  19           H        VAL  19   5.235  -0.724   1.398
  147    HA   VAL  19           HA       VAL  19   7.578   0.732   1.904
  148    HB   VAL  19           HB       VAL  19   5.862  -1.095   3.506
  149   HG11  VAL  19          HG11      VAL  19   8.678  -0.336   4.237
  150   HG12  VAL  19          HG12      VAL  19   7.462  -0.753   5.446
  151   HG13  VAL  19          HG13      VAL  19   7.941  -1.938   4.231
  152   HG21  VAL  19          HG21      VAL  19   5.717   0.846   4.960
  153   HG22  VAL  19          HG22      VAL  19   6.942   1.679   4.003
  154   HG23  VAL  19          HG23      VAL  19   5.372   1.305   3.292
  155    H    LYS  20           H        LYS  20   7.028  -2.776   1.750
  156    HA   LYS  20           HA       LYS  20   9.696  -3.515   2.315
  157    HB2  LYS  20           HB2      LYS  20   7.480  -4.990   0.886
  158    HB3  LYS  20           HB3      LYS  20   9.024  -5.719   1.309
  159    HG2  LYS  20           HG2      LYS  20   8.540  -5.788   3.540
  160    HG3  LYS  20           HG3      LYS  20   7.448  -4.404   3.459
  161    HD2  LYS  20           HD2      LYS  20   6.903  -7.200   2.465
  162    HD3  LYS  20           HD3      LYS  20   6.173  -6.415   3.868
  163    HE2  LYS  20           HE2      LYS  20   4.517  -5.976   2.394
  164    HE3  LYS  20           HE3      LYS  20   5.558  -4.615   1.977
  165    HZ1  LYS  20           HZ1      LYS  20   5.629  -5.400  -0.076
  166    HZ2  LYS  20           HZ2      LYS  20   4.745  -6.775   0.357
  167    HZ3  LYS  20           HZ3      LYS  20   6.432  -6.781   0.482
  168    H    LYS  21           H        LYS  21   7.938  -3.095  -0.739
  169    HA   LYS  21           HA       LYS  21  10.053  -3.857  -2.438
  170    HB2  LYS  21           HB2      LYS  21   7.610  -2.144  -2.855
  171    HB3  LYS  21           HB3      LYS  21   8.757  -2.459  -4.150
  172    HG2  LYS  21           HG2      LYS  21   7.406  -4.656  -2.611
  173    HG3  LYS  21           HG3      LYS  21   6.717  -3.939  -4.070
  174    HD2  LYS  21           HD2      LYS  21   8.796  -4.534  -5.285
  175    HD3  LYS  21           HD3      LYS  21   9.377  -5.347  -3.830
  176    HE2  LYS  21           HE2      LYS  21   7.868  -7.066  -4.025
  177    HE3  LYS  21           HE3      LYS  21   6.700  -6.083  -4.907
  178    HZ1  LYS  21           HZ1      LYS  21   9.046  -6.307  -6.435
  179    HZ2  LYS  21           HZ2      LYS  21   7.494  -6.872  -6.800
  180    HZ3  LYS  21           HZ3      LYS  21   8.576  -7.858  -5.951
  181    H    TYR  22           H        TYR  22   9.104  -0.740  -1.080
  182    HA   TYR  22           HA       TYR  22  11.000   0.789  -2.552
  183    HB2  TYR  22           HB2      TYR  22   9.249   1.297  -0.178
  184    HB3  TYR  22           HB3      TYR  22  10.529   2.442  -0.563
  185    HD1  TYR  22           HD1      TYR  22   8.240   0.500  -2.783
  186    HD2  TYR  22           HD2      TYR  22   9.508   4.332  -1.435
  187    HE1  TYR  22           HE1      TYR  22   6.778   1.564  -4.450
  188    HE2  TYR  22           HE2      TYR  22   8.048   5.406  -3.098
  189    HH   TYR  22           HH       TYR  22   5.706   3.630  -4.908
  190    H    LEU  23           H        LEU  23  10.921  -0.318   0.835
  191    HA   LEU  23           HA       LEU  23  13.497   0.617   1.494
  192    HB2  LEU  23           HB2      LEU  23  13.264  -0.546   3.510
  193    HB3  LEU  23           HB3      LEU  23  11.627  -0.072   3.062
  194    HG   LEU  23           HG       LEU  23  11.520  -2.484   2.052
  195   HD11  LEU  23          HD11      LEU  23  13.860  -2.609   3.921
  196   HD12  LEU  23          HD12      LEU  23  13.707  -3.257   2.288
  197   HD13  LEU  23          HD13      LEU  23  12.841  -4.018   3.622
  198   HD21  LEU  23          HD21      LEU  23  11.303  -1.673   4.930
  199   HD22  LEU  23          HD22      LEU  23  10.916  -3.314   4.412
  200   HD23  LEU  23          HD23      LEU  23  10.020  -1.945   3.751
  201    H    ASN  24           H        ASN  24  12.338  -2.420   0.155
  202    HA   ASN  24           HA       ASN  24  14.804  -3.819   0.417
  203    HB2  ASN  24           HB2      ASN  24  12.681  -5.013   0.188
  204    HB3  ASN  24           HB3      ASN  24  12.452  -4.329  -1.418
  205   HD21  ASN  24          HD21      ASN  24  14.098  -4.862  -3.036
  206   HD22  ASN  24          HD22      ASN  24  14.828  -6.427  -2.983
  207    H    SER  25           H        SER  25  13.287  -1.961  -2.178
  208    HA   SER  25           HA       SER  25  15.244  -2.533  -4.146
  209    HB2  SER  25           HB2      SER  25  12.895  -1.614  -4.525
  210    HB3  SER  25           HB3      SER  25  13.540  -0.042  -4.052
  211    HG   SER  25           HG       SER  25  14.398  -1.660  -6.221
  212    H    ILE  26           H        ILE  26  14.809   0.168  -1.892
  213    HA   ILE  26           HA       ILE  26  16.920   1.770  -2.764
  214    HB   ILE  26           HB       ILE  26  15.722   1.454  -0.015
  215   HG12  ILE  26          HG12      ILE  26  15.460   3.746  -1.960
  216   HG13  ILE  26          HG13      ILE  26  14.355   2.376  -1.959
  217   HG21  ILE  26          HG21      ILE  26  18.016   3.072  -0.944
  218   HG22  ILE  26          HG22      ILE  26  16.853   3.871   0.113
  219   HG23  ILE  26          HG23      ILE  26  17.669   2.403   0.651
  220   HD11  ILE  26          HD11      ILE  26  14.391   3.176   0.676
  221   HD12  ILE  26          HD12      ILE  26  14.448   4.691  -0.226
  222   HD13  ILE  26          HD13      ILE  26  13.142   3.541  -0.515
  223    H    LEU  27           H        LEU  27  16.878  -0.840  -0.365
  224    HA   LEU  27           HA       LEU  27  19.607  -0.574   0.372
  225    HB2  LEU  27           HB2      LEU  27  17.595  -2.785   0.671
  226    HB3  LEU  27           HB3      LEU  27  19.258  -2.949   1.234
  227    HG   LEU  27           HG       LEU  27  17.660  -0.623   2.187
  228   HD11  LEU  27          HD11      LEU  27  16.641  -3.200   2.405
  229   HD12  LEU  27          HD12      LEU  27  16.176  -1.790   3.356
  230   HD13  LEU  27          HD13      LEU  27  17.417  -2.889   3.959
  231   HD21  LEU  27          HD21      LEU  27  20.181  -1.433   2.657
  232   HD22  LEU  27          HD22      LEU  27  19.341  -2.277   3.958
  233   HD23  LEU  27          HD23      LEU  27  19.215  -0.523   3.819
  234    H    ASN  28           H        ASN  28  17.898  -2.617  -1.955
  235    HA   ASN  28           HA       ASN  28  19.866  -4.360  -2.721
  236    HB2  ASN  28           HB2      ASN  28  17.586  -3.075  -4.143
  237    HB3  ASN  28           HB3      ASN  28  18.777  -3.929  -5.121
  238   HD21  ASN  28          HD21      ASN  28  16.238  -4.816  -5.109
  239   HD22  ASN  28          HD22      ASN  28  16.118  -6.304  -4.239
  240    H    GLY  29           H        GLY  29  19.507  -0.972  -3.626
  241    HA2  GLY  29           HA2      GLY  29  20.819   0.361  -5.009
  242    HA3  GLY  29           HA3      GLY  29  22.062  -0.234  -3.918
  Start of MODEL   14
    1    H1   HIS   1           H        HIS   1 -22.100   8.650   1.493
    2    HA   HIS   1           HA       HIS   1 -19.835   7.109   2.574
    3    HB2  HIS   1           HB2      HIS   1 -22.594   6.031   1.958
    4    HB3  HIS   1           HB3      HIS   1 -21.224   5.093   2.545
    5    HD1  HIS   1           HD1      HIS   1 -23.448   7.950   3.687
    6    HD2  HIS   1           HD2      HIS   1 -21.063   4.931   5.253
    7    HE1  HIS   1           HE1      HIS   1 -23.814   8.026   6.173
    8    HE2  HIS   1           HE2      HIS   1 -22.296   6.247   7.107
    9    H    SER   2           H        SER   2 -18.563   7.528   0.764
   10    HA   SER   2           HA       SER   2 -19.568   6.484  -1.797
   11    HB2  SER   2           HB2      SER   2 -17.260   8.374  -1.275
   12    HB3  SER   2           HB3      SER   2 -17.811   7.837  -2.862
   13    HG   SER   2           HG       SER   2 -19.268   9.334  -2.788
   14    H    ASP   3           H        ASP   3 -18.756   4.642   0.110
   15    HA   ASP   3           HA       ASP   3 -17.439   2.807   0.379
   16    HB2  ASP   3           HB2      ASP   3 -16.846   3.556  -2.471
   17    HB3  ASP   3           HB3      ASP   3 -16.019   2.202  -1.706
   18    H    ALA   4           H        ALA   4 -16.473   5.267   1.393
   19    HA   ALA   4           HA       ALA   4 -13.792   5.804   0.788
   20    HB1  ALA   4           HB1      ALA   4 -13.858   7.278   2.508
   21    HB2  ALA   4           HB2      ALA   4 -15.593   6.996   2.357
   22    HB3  ALA   4           HB3      ALA   4 -14.666   6.147   3.594
   23    H    VAL   5           H        VAL   5 -15.253   3.516   3.046
   24    HA   VAL   5           HA       VAL   5 -12.877   2.717   4.338
   25    HB   VAL   5           HB       VAL   5 -15.124   2.227   5.228
   26   HG11  VAL   5          HG11      VAL   5 -16.516   0.520   4.312
   27   HG12  VAL   5          HG12      VAL   5 -16.118   1.638   3.006
   28   HG13  VAL   5          HG13      VAL   5 -15.293   0.083   3.119
   29   HG21  VAL   5          HG21      VAL   5 -14.564  -0.395   5.482
   30   HG22  VAL   5          HG22      VAL   5 -13.008   0.197   4.899
   31   HG23  VAL   5          HG23      VAL   5 -13.716   0.874   6.366
   32    H    PHE   6           H        PHE   6 -14.519   1.549   1.439
   33    HA   PHE   6           HA       PHE   6 -12.985  -0.758   1.014
   34    HB2  PHE   6           HB2      PHE   6 -14.561   1.037  -0.811
   35    HB3  PHE   6           HB3      PHE   6 -13.641  -0.318  -1.456
   36    HD1  PHE   6           HD1      PHE   6 -16.137   0.433   1.210
   37    HD2  PHE   6           HD2      PHE   6 -14.690  -2.351  -1.667
   38    HE1  PHE   6           HE1      PHE   6 -18.007  -1.078   1.736
   39    HE2  PHE   6           HE2      PHE   6 -16.558  -3.865  -1.145
   40    HZ   PHE   6           HZ       PHE   6 -18.220  -3.229   0.557
   41    H    THR   7           H        THR   7 -12.620   2.483  -0.423
   42    HA   THR   7           HA       THR   7 -10.190   1.888  -1.750
   43    HB   THR   7           HB       THR   7 -11.632   3.759  -2.436
   44    HG1  THR   7           HG1      THR   7  -8.930   4.153  -1.769
   45   HG21  THR   7          HG21      THR   7 -10.630   5.211   0.009
   46   HG22  THR   7          HG22      THR   7 -12.218   4.450  -0.087
   47   HG23  THR   7          HG23      THR   7 -11.808   5.776  -1.175
   48    H    ASP   8           H        ASP   8 -10.942   3.295   1.396
   49    HA   ASP   8           HA       ASP   8  -8.397   4.179   2.113
   50    HB2  ASP   8           HB2      ASP   8  -9.990   4.888   3.613
   51    HB3  ASP   8           HB3      ASP   8 -10.833   3.342   3.614
   52    H    ASN   9           H        ASN   9  -9.825   0.970   2.242
   53    HA   ASN   9           HA       ASN   9  -7.729  -0.222   3.760
   54    HB2  ASN   9           HB2      ASN   9  -9.899  -1.276   3.725
   55    HB3  ASN   9           HB3      ASN   9  -9.850  -1.423   1.970
   56   HD21  ASN   9          HD21      ASN   9 -10.072  -3.404   4.202
   57   HD22  ASN   9          HD22      ASN   9  -8.836  -4.567   3.876
   58    H    TYR  10           H        TYR  10  -8.433   0.036   0.304
   59    HA   TYR  10           HA       TYR  10  -6.285  -1.597  -0.562
   60    HB2  TYR  10           HB2      TYR  10  -7.655   0.619  -2.098
   61    HB3  TYR  10           HB3      TYR  10  -6.740  -0.723  -2.775
   62    HD1  TYR  10           HD1      TYR  10  -7.802  -2.974  -1.152
   63    HD2  TYR  10           HD2      TYR  10  -9.800   0.309  -2.976
   64    HE1  TYR  10           HE1      TYR  10  -9.862  -4.312  -1.290
   65    HE2  TYR  10           HE2      TYR  10 -11.865  -1.019  -3.118
   66    HH   TYR  10           HH       TYR  10 -12.512  -3.416  -3.174
   67    H    THR  11           H        THR  11  -6.657   1.919  -0.244
   68    HA   THR  11           HA       THR  11  -4.096   2.595  -1.214
   69    HB   THR  11           HB       THR  11  -5.823   4.283  -1.098
   70    HG1  THR  11           HG1      THR  11  -4.534   5.808   0.397
   71   HG21  THR  11          HG21      THR  11  -6.684   3.231   1.162
   72   HG22  THR  11          HG22      THR  11  -6.950   4.936   0.797
   73   HG23  THR  11          HG23      THR  11  -5.637   4.459   1.873
   74    H    ARG  12           H        ARG  12  -5.314   1.950   2.044
   75    HA   ARG  12           HA       ARG  12  -2.914   2.624   3.396
   76    HB2  ARG  12           HB2      ARG  12  -5.028   2.561   4.583
   77    HB3  ARG  12           HB3      ARG  12  -5.219   0.851   4.219
   78    HG2  ARG  12           HG2      ARG  12  -2.987   0.577   5.499
   79    HG3  ARG  12           HG3      ARG  12  -3.363   2.174   6.148
   80    HD2  ARG  12           HD2      ARG  12  -5.436   0.024   6.200
   81    HD3  ARG  12           HD3      ARG  12  -4.148   0.023   7.403
   82    HE   ARG  12           HE       ARG  12  -5.255   2.583   7.327
   83   HH11  ARG  12          HH12      ARG  12  -6.173  -0.659   8.200
   84   HH12  ARG  12          HH11      ARG  12  -7.317  -0.153   9.398
   85   HH21  ARG  12          HH22      ARG  12  -6.758   3.263   8.902
   86   HH22  ARG  12          HH21      ARG  12  -7.650   2.079   9.796
   87    H    LEU  13           H        LEU  13  -4.243  -0.433   2.199
   88    HA   LEU  13           HA       LEU  13  -2.193  -2.086   3.225
   89    HB2  LEU  13           HB2      LEU  13  -4.348  -2.971   2.543
   90    HB3  LEU  13           HB3      LEU  13  -4.039  -2.490   0.876
   91    HG   LEU  13           HG       LEU  13  -1.968  -4.101   1.153
   92   HD11  LEU  13          HD11      LEU  13  -2.059  -4.803   3.346
   93   HD12  LEU  13          HD12      LEU  13  -2.905  -6.109   2.516
   94   HD13  LEU  13          HD13      LEU  13  -3.822  -4.865   3.366
   95   HD21  LEU  13          HD21      LEU  13  -3.765  -4.349  -0.482
   96   HD22  LEU  13          HD22      LEU  13  -4.795  -5.077   0.751
   97   HD23  LEU  13          HD23      LEU  13  -3.327  -5.904   0.225
   98    H    ARG  14           H        ARG  14  -2.613  -0.407   0.148
   99    HA   ARG  14           HA       ARG  14  -0.450  -1.536  -1.227
  100    HB2  ARG  14           HB2      ARG  14  -2.380   0.125  -1.970
  101    HB3  ARG  14           HB3      ARG  14  -1.140   1.333  -1.660
  102    HG2  ARG  14           HG2      ARG  14   0.334  -0.201  -3.166
  103    HG3  ARG  14           HG3      ARG  14  -1.224  -0.806  -3.731
  104    HD2  ARG  14           HD2      ARG  14  -1.844   1.649  -4.083
  105    HD3  ARG  14           HD3      ARG  14  -0.122   1.982  -3.898
  106    HE   ARG  14           HE       ARG  14  -1.424   0.781  -6.163
  107   HH11  ARG  14          HH12      ARG  14   1.574   1.121  -4.426
  108   HH12  ARG  14          HH11      ARG  14   2.563   0.762  -5.802
  109   HH21  ARG  14          HH22      ARG  14  -0.133   0.306  -7.982
  110   HH22  ARG  14          HH21      ARG  14   1.591   0.300  -7.825
  111    H    LYS  15           H        LYS  15  -0.623   1.148   1.041
  112    HA   LYS  15           HA       LYS  15   1.926   2.227   0.648
  113    HB2  LYS  15           HB2      LYS  15   0.133   3.288   1.993
  114    HB3  LYS  15           HB3      LYS  15   0.371   2.069   3.237
  115    HG2  LYS  15           HG2      LYS  15   1.544   3.925   4.010
  116    HG3  LYS  15           HG3      LYS  15   2.790   2.880   3.324
  117    HD2  LYS  15           HD2      LYS  15   2.269   4.298   1.151
  118    HD3  LYS  15           HD3      LYS  15   1.732   5.482   2.344
  119    HE2  LYS  15           HE2      LYS  15   3.876   5.522   3.381
  120    HE3  LYS  15           HE3      LYS  15   4.422   4.132   2.444
  121    HZ1  LYS  15           HZ1      LYS  15   4.469   6.893   1.760
  122    HZ2  LYS  15           HZ2      LYS  15   3.647   5.997   0.584
  123    HZ3  LYS  15           HZ3      LYS  15   5.235   5.588   1.002
  124    H    GLN  16           H        GLN  16   0.848  -0.500   2.598
  125    HA   GLN  16           HA       GLN  16   3.326  -0.904   3.933
  126    HB2  GLN  16           HB2      GLN  16   0.864  -2.572   3.528
  127    HB3  GLN  16           HB3      GLN  16   2.299  -3.266   4.271
  128    HG2  GLN  16           HG2      GLN  16   0.873  -0.813   5.274
  129    HG3  GLN  16           HG3      GLN  16   0.628  -2.445   5.896
  130   HE21  GLN  16          HE21      GLN  16   2.840   0.233   5.654
  131   HE22  GLN  16          HE22      GLN  16   3.915  -0.282   6.904
  132    H    MET  17           H        MET  17   1.804  -2.441   1.113
  133    HA   MET  17           HA       MET  17   3.900  -4.259   0.597
  134    HB2  MET  17           HB2      MET  17   1.853  -3.091  -1.297
  135    HB3  MET  17           HB3      MET  17   2.874  -4.480  -1.642
  136    HG2  MET  17           HG2      MET  17   1.798  -5.411   0.563
  137    HG3  MET  17           HG3      MET  17   0.534  -4.247   0.174
  138    HE1  MET  17           HE1      MET  17  -0.912  -5.456  -3.146
  139    HE2  MET  17           HE2      MET  17  -0.786  -4.173  -1.943
  140    HE3  MET  17           HE3      MET  17   0.489  -4.384  -3.145
  141    H    ALA  18           H        ALA  18   3.246  -0.982  -0.546
  142    HA   ALA  18           HA       ALA  18   5.438  -0.923  -2.381
  143    HB1  ALA  18           HB1      ALA  18   3.218   0.675  -1.875
  144    HB2  ALA  18           HB2      ALA  18   4.604   1.692  -1.482
  145    HB3  ALA  18           HB3      ALA  18   4.475   0.956  -3.079
  146    H    VAL  19           H        VAL  19   5.050  -0.298   1.006
  147    HA   VAL  19           HA       VAL  19   7.332   1.336   1.394
  148    HB   VAL  19           HB       VAL  19   5.551  -0.254   3.172
  149   HG11  VAL  19          HG11      VAL  19   8.315   0.667   3.905
  150   HG12  VAL  19          HG12      VAL  19   7.046   0.443   5.110
  151   HG13  VAL  19          HG13      VAL  19   7.590  -0.923   4.135
  152   HG21  VAL  19          HG21      VAL  19   6.392   2.395   4.014
  153   HG22  VAL  19          HG22      VAL  19   5.724   2.390   2.382
  154   HG23  VAL  19          HG23      VAL  19   4.771   1.763   3.727
  155    H    LYS  20           H        LYS  20   6.805  -2.157   1.823
  156    HA   LYS  20           HA       LYS  20   9.475  -2.737   2.568
  157    HB2  LYS  20           HB2      LYS  20   8.847  -5.098   2.051
  158    HB3  LYS  20           HB3      LYS  20   7.730  -4.287   3.140
  159    HG2  LYS  20           HG2      LYS  20   6.427  -3.769   0.931
  160    HG3  LYS  20           HG3      LYS  20   7.339  -5.151   0.319
  161    HD2  LYS  20           HD2      LYS  20   5.283  -6.005   1.139
  162    HD3  LYS  20           HD3      LYS  20   6.516  -6.436   2.327
  163    HE2  LYS  20           HE2      LYS  20   5.743  -4.076   3.331
  164    HE3  LYS  20           HE3      LYS  20   4.244  -4.551   2.535
  165    HZ1  LYS  20           HZ1      LYS  20   4.317  -6.644   3.763
  166    HZ2  LYS  20           HZ2      LYS  20   4.278  -5.317   4.811
  167    HZ3  LYS  20           HZ3      LYS  20   5.729  -6.148   4.552
  168    H    LYS  21           H        LYS  21   7.774  -2.746  -0.525
  169    HA   LYS  21           HA       LYS  21   9.844  -3.902  -2.056
  170    HB2  LYS  21           HB2      LYS  21   7.477  -3.701  -2.795
  171    HB3  LYS  21           HB3      LYS  21   7.710  -1.967  -2.974
  172    HG2  LYS  21           HG2      LYS  21   8.045  -2.624  -5.123
  173    HG3  LYS  21           HG3      LYS  21   9.700  -2.743  -4.521
  174    HD2  LYS  21           HD2      LYS  21   9.460  -5.119  -4.194
  175    HD3  LYS  21           HD3      LYS  21   7.748  -5.042  -4.618
  176    HE2  LYS  21           HE2      LYS  21  10.019  -4.329  -6.470
  177    HE3  LYS  21           HE3      LYS  21   9.182  -5.880  -6.457
  178    HZ1  LYS  21           HZ1      LYS  21   7.243  -3.892  -6.620
  179    HZ2  LYS  21           HZ2      LYS  21   7.683  -5.009  -7.811
  180    HZ3  LYS  21           HZ3      LYS  21   8.437  -3.496  -7.751
  181    H    TYR  22           H        TYR  22   9.048  -0.549  -1.267
  182    HA   TYR  22           HA       TYR  22  11.030   0.623  -2.921
  183    HB2  TYR  22           HB2      TYR  22   9.358   1.585  -0.628
  184    HB3  TYR  22           HB3      TYR  22  10.678   2.585  -1.222
  185    HD1  TYR  22           HD1      TYR  22   8.278   0.426  -3.088
  186    HD2  TYR  22           HD2      TYR  22   9.677   4.370  -2.323
  187    HE1  TYR  22           HE1      TYR  22   6.819   1.283  -4.872
  188    HE2  TYR  22           HE2      TYR  22   8.220   5.239  -4.104
  189    HH   TYR  22           HH       TYR  22   6.465   3.107  -6.245
  190    H    LEU  23           H        LEU  23  10.928   0.066   0.599
  191    HA   LEU  23           HA       LEU  23  13.549   0.936   1.116
  192    HB2  LEU  23           HB2      LEU  23  13.325  -0.203   3.250
  193    HB3  LEU  23           HB3      LEU  23  11.864   0.701   2.857
  194    HG   LEU  23           HG       LEU  23  11.030  -1.626   1.979
  195   HD11  LEU  23          HD11      LEU  23  12.593  -2.775   4.188
  196   HD12  LEU  23          HD12      LEU  23  13.500  -2.425   2.717
  197   HD13  LEU  23          HD13      LEU  23  12.094  -3.488   2.654
  198   HD21  LEU  23          HD21      LEU  23   9.668  -1.048   3.647
  199   HD22  LEU  23          HD22      LEU  23  10.974  -0.302   4.568
  200   HD23  LEU  23          HD23      LEU  23  10.696  -2.040   4.681
  201    H    ASN  24           H        ASN  24  12.241  -2.233   0.284
  202    HA   ASN  24           HA       ASN  24  14.609  -3.709   0.720
  203    HB2  ASN  24           HB2      ASN  24  12.473  -4.839   0.555
  204    HB3  ASN  24           HB3      ASN  24  12.248  -4.253  -1.091
  205   HD21  ASN  24          HD21      ASN  24  13.583  -5.092  -2.749
  206   HD22  ASN  24          HD22      ASN  24  14.338  -6.637  -2.579
  207    H    SER  25           H        SER  25  13.310  -2.048  -2.114
  208    HA   SER  25           HA       SER  25  15.305  -2.957  -3.921
  209    HB2  SER  25           HB2      SER  25  13.564  -0.485  -4.091
  210    HB3  SER  25           HB3      SER  25  14.456  -1.217  -5.424
  211    HG   SER  25           HG       SER  25  13.169  -3.118  -5.075
  212    H    ILE  26           H        ILE  26  14.879   0.093  -2.142
  213    HA   ILE  26           HA       ILE  26  17.158   1.404  -3.066
  214    HB   ILE  26           HB       ILE  26  15.798   1.625  -0.380
  215   HG12  ILE  26          HG12      ILE  26  15.627   3.495  -2.742
  216   HG13  ILE  26          HG13      ILE  26  14.504   2.160  -2.511
  217   HG21  ILE  26          HG21      ILE  26  17.341   3.078   0.282
  218   HG22  ILE  26          HG22      ILE  26  18.301   2.626  -1.126
  219   HG23  ILE  26          HG23      ILE  26  17.192   3.994  -1.218
  220   HD11  ILE  26          HD11      ILE  26  13.293   3.751  -1.488
  221   HD12  ILE  26          HD12      ILE  26  14.314   3.336  -0.110
  222   HD13  ILE  26          HD13      ILE  26  14.705   4.737  -1.107
  223    H    LEU  27           H        LEU  27  16.751  -0.777  -0.303
  224    HA   LEU  27           HA       LEU  27  19.401  -0.528   0.662
  225    HB2  LEU  27           HB2      LEU  27  17.158  -2.443   1.086
  226    HB3  LEU  27           HB3      LEU  27  18.768  -2.876   1.657
  227    HG   LEU  27           HG       LEU  27  17.519  -0.272   2.454
  228   HD11  LEU  27          HD11      LEU  27  16.849  -1.585   4.565
  229   HD12  LEU  27          HD12      LEU  27  16.917  -3.004   3.520
  230   HD13  LEU  27          HD13      LEU  27  15.809  -1.684   3.143
  231   HD21  LEU  27          HD21      LEU  27  19.936  -0.769   2.860
  232   HD22  LEU  27          HD22      LEU  27  19.428  -2.096   3.905
  233   HD23  LEU  27          HD23      LEU  27  19.000  -0.435   4.317
  234    H    ASN  28           H        ASN  28  17.837  -2.813  -1.539
  235    HA   ASN  28           HA       ASN  28  19.818  -4.693  -1.850
  236    HB2  ASN  28           HB2      ASN  28  17.496  -4.591  -2.940
  237    HB3  ASN  28           HB3      ASN  28  18.260  -3.625  -4.199
  238   HD21  ASN  28          HD21      ASN  28  17.039  -6.025  -4.751
  239   HD22  ASN  28          HD22      ASN  28  18.235  -7.181  -5.219
  240    H    GLY  29           H        GLY  29  19.606  -1.480  -3.289
  241    HA2  GLY  29           HA2      GLY  29  22.107  -1.916  -4.743
  242    HA3  GLY  29           HA3      GLY  29  21.045  -0.525  -4.901
  Start of MODEL   15
    1    H1   HIS   1           H        HIS   1 -21.778   9.201   1.283
    2    HA   HIS   1           HA       HIS   1 -20.846   7.655  -0.946
    3    HB2  HIS   1           HB2      HIS   1 -19.340  10.099  -0.054
    4    HB3  HIS   1           HB3      HIS   1 -18.491   8.721  -0.748
    5    HD1  HIS   1           HD1      HIS   1 -20.538   8.024  -2.982
    6    HD2  HIS   1           HD2      HIS   1 -19.146  11.848  -2.145
    7    HE1  HIS   1           HE1      HIS   1 -20.852   9.333  -5.106
    8    HE2  HIS   1           HE2      HIS   1 -19.924  11.620  -4.602
    9    H    SER   2           H        SER   2 -20.290   5.784  -0.070
   10    HA   SER   2           HA       SER   2 -18.960   5.797   2.559
   11    HB2  SER   2           HB2      SER   2 -20.107   3.618   3.008
   12    HB3  SER   2           HB3      SER   2 -21.215   4.984   2.879
   13    HG   SER   2           HG       SER   2 -21.394   4.292   0.583
   14    H    ASP   3           H        ASP   3 -18.715   5.031  -0.667
   15    HA   ASP   3           HA       ASP   3 -17.286   2.582  -0.562
   16    HB2  ASP   3           HB2      ASP   3 -18.185   3.100  -2.665
   17    HB3  ASP   3           HB3      ASP   3 -17.571   4.750  -2.624
   18    H    ALA   4           H        ALA   4 -16.471   5.602   0.552
   19    HA   ALA   4           HA       ALA   4 -13.790   5.911  -0.185
   20    HB1  ALA   4           HB1      ALA   4 -14.267   7.796   0.900
   21    HB2  ALA   4           HB2      ALA   4 -15.589   7.040   1.791
   22    HB3  ALA   4           HB3      ALA   4 -13.935   6.910   2.389
   23    H    VAL   5           H        VAL   5 -15.279   4.033   2.403
   24    HA   VAL   5           HA       VAL   5 -12.931   3.345   3.788
   25    HB   VAL   5           HB       VAL   5 -15.126   3.001   4.778
   26   HG11  VAL   5          HG11      VAL   5 -16.790   1.723   3.910
   27   HG12  VAL   5          HG12      VAL   5 -15.970   2.132   2.402
   28   HG13  VAL   5          HG13      VAL   5 -15.675   0.573   3.173
   29   HG21  VAL   5          HG21      VAL   5 -14.814   0.569   5.484
   30   HG22  VAL   5          HG22      VAL   5 -13.415   0.558   4.410
   31   HG23  VAL   5          HG23      VAL   5 -13.468   1.670   5.778
   32    H    PHE   6           H        PHE   6 -14.567   1.858   1.039
   33    HA   PHE   6           HA       PHE   6 -13.096  -0.522   0.923
   34    HB2  PHE   6           HB2      PHE   6 -14.549   1.087  -1.166
   35    HB3  PHE   6           HB3      PHE   6 -13.701  -0.399  -1.579
   36    HD1  PHE   6           HD1      PHE   6 -16.390   0.991   0.550
   37    HD2  PHE   6           HD2      PHE   6 -14.680  -2.491  -1.202
   38    HE1  PHE   6           HE1      PHE   6 -18.360  -0.315   1.232
   39    HE2  PHE   6           HE2      PHE   6 -16.648  -3.803  -0.523
   40    HZ   PHE   6           HZ       PHE   6 -18.492  -2.715   0.695
   41    H    THR   7           H        THR   7 -12.598   2.512  -0.879
   42    HA   THR   7           HA       THR   7 -10.165   1.688  -2.072
   43    HB   THR   7           HB       THR   7 -11.531   3.506  -3.011
   44    HG1  THR   7           HG1      THR   7  -9.413   3.585  -3.650
   45   HG21  THR   7          HG21      THR   7 -10.643   5.024  -0.556
   46   HG22  THR   7          HG22      THR   7 -12.295   4.583  -0.988
   47   HG23  THR   7          HG23      THR   7 -11.411   5.755  -1.965
   48    H    ASP   8           H        ASP   8 -10.930   3.485   0.866
   49    HA   ASP   8           HA       ASP   8  -8.383   4.385   1.534
   50    HB2  ASP   8           HB2      ASP   8 -10.009   5.277   2.905
   51    HB3  ASP   8           HB3      ASP   8 -10.849   3.739   3.088
   52    H    ASN   9           H        ASN   9  -9.953   1.293   2.281
   53    HA   ASN   9           HA       ASN   9  -7.922   0.218   3.880
   54    HB2  ASN   9           HB2      ASN   9 -10.306  -0.661   3.467
   55    HB3  ASN   9           HB3      ASN   9  -9.632  -1.447   2.042
   56   HD21  ASN   9          HD21      ASN   9 -10.760  -2.993   3.912
   57   HD22  ASN   9          HD22      ASN   9  -9.561  -3.875   4.789
   58    H    TYR  10           H        TYR  10  -8.438   0.056   0.378
   59    HA   TYR  10           HA       TYR  10  -6.245  -1.644  -0.171
   60    HB2  TYR  10           HB2      TYR  10  -7.486   0.382  -2.040
   61    HB3  TYR  10           HB3      TYR  10  -6.580  -1.060  -2.487
   62    HD1  TYR  10           HD1      TYR  10  -7.814  -3.034  -0.616
   63    HD2  TYR  10           HD2      TYR  10  -9.577  -0.005  -3.028
   64    HE1  TYR  10           HE1      TYR  10  -9.905  -4.325  -0.698
   65    HE2  TYR  10           HE2      TYR  10 -11.674  -1.287  -3.116
   66    HH   TYR  10           HH       TYR  10 -12.773  -3.132  -1.482
   67    H    THR  11           H        THR  11  -6.611   1.875  -0.139
   68    HA   THR  11           HA       THR  11  -4.056   2.513  -1.128
   69    HB   THR  11           HB       THR  11  -5.790   4.128   0.751
   70    HG1  THR  11           HG1      THR  11  -6.868   4.714  -0.993
   71   HG21  THR  11          HG21      THR  11  -3.162   4.595  -0.346
   72   HG22  THR  11          HG22      THR  11  -4.081   5.561   0.808
   73   HG23  THR  11          HG23      THR  11  -4.306   5.806  -0.923
   74    H    ARG  12           H        ARG  12  -5.253   2.053   2.175
   75    HA   ARG  12           HA       ARG  12  -2.783   2.716   3.429
   76    HB2  ARG  12           HB2      ARG  12  -4.837   2.914   4.678
   77    HB3  ARG  12           HB3      ARG  12  -5.205   1.212   4.427
   78    HG2  ARG  12           HG2      ARG  12  -3.069   0.716   5.707
   79    HG3  ARG  12           HG3      ARG  12  -3.081   2.420   6.167
   80    HD2  ARG  12           HD2      ARG  12  -5.527   0.750   6.565
   81    HD3  ARG  12           HD3      ARG  12  -4.193   0.639   7.713
   82    HE   ARG  12           HE       ARG  12  -5.104   3.323   7.152
   83   HH11  ARG  12          HH12      ARG  12  -5.412   0.514   9.185
   84   HH12  ARG  12          HH11      ARG  12  -6.088   1.391  10.518
   85   HH21  ARG  12          HH22      ARG  12  -5.994   4.489   8.899
   86   HH22  ARG  12          HH21      ARG  12  -6.420   3.652  10.353
   87    H    LEU  13           H        LEU  13  -4.346  -0.332   2.529
   88    HA   LEU  13           HA       LEU  13  -2.413  -2.042   3.664
   89    HB2  LEU  13           HB2      LEU  13  -4.553  -2.916   3.096
   90    HB3  LEU  13           HB3      LEU  13  -4.375  -2.421   1.414
   91    HG   LEU  13           HG       LEU  13  -2.317  -4.107   1.551
   92   HD11  LEU  13          HD11      LEU  13  -3.362  -6.118   2.869
   93   HD12  LEU  13          HD12      LEU  13  -4.112  -4.831   3.813
   94   HD13  LEU  13          HD13      LEU  13  -2.356  -4.924   3.690
   95   HD21  LEU  13          HD21      LEU  13  -4.586  -5.768   1.204
   96   HD22  LEU  13          HD22      LEU  13  -3.573  -5.021  -0.031
   97   HD23  LEU  13          HD23      LEU  13  -4.990  -4.168   0.583
   98    H    ARG  14           H        ARG  14  -2.734  -0.622   0.440
   99    HA   ARG  14           HA       ARG  14  -0.642  -1.986  -0.815
  100    HB2  ARG  14           HB2      ARG  14  -2.441  -0.363  -1.778
  101    HB3  ARG  14           HB3      ARG  14  -1.248   0.885  -1.439
  102    HG2  ARG  14           HG2      ARG  14   0.323  -0.789  -2.766
  103    HG3  ARG  14           HG3      ARG  14  -1.222  -1.268  -3.471
  104    HD2  ARG  14           HD2      ARG  14  -0.498   0.414  -4.897
  105    HD3  ARG  14           HD3      ARG  14  -1.594   1.262  -3.808
  106    HE   ARG  14           HE       ARG  14   0.187   2.453  -2.986
  107   HH11  ARG  14          HH12      ARG  14   1.355  -0.236  -4.865
  108   HH12  ARG  14          HH11      ARG  14   3.002   0.299  -4.846
  109   HH21  ARG  14          HH22      ARG  14   2.353   3.167  -2.955
  110   HH22  ARG  14          HH21      ARG  14   3.569   2.234  -3.759
  111    H    LYS  15           H        LYS  15  -0.640   0.883   1.220
  112    HA   LYS  15           HA       LYS  15   1.956   1.785   0.755
  113    HB2  LYS  15           HB2      LYS  15   0.555   3.207   2.000
  114    HB3  LYS  15           HB3      LYS  15   0.138   1.939   3.146
  115    HG2  LYS  15           HG2      LYS  15   1.655   3.679   4.056
  116    HG3  LYS  15           HG3      LYS  15   2.301   2.039   4.153
  117    HD2  LYS  15           HD2      LYS  15   4.104   3.322   3.393
  118    HD3  LYS  15           HD3      LYS  15   3.463   2.572   1.930
  119    HE2  LYS  15           HE2      LYS  15   2.571   5.297   2.813
  120    HE3  LYS  15           HE3      LYS  15   4.041   5.077   1.866
  121    HZ1  LYS  15           HZ1      LYS  15   1.265   4.825   1.062
  122    HZ2  LYS  15           HZ2      LYS  15   2.309   3.649   0.438
  123    HZ3  LYS  15           HZ3      LYS  15   2.617   5.289   0.157
  124    H    GLN  16           H        GLN  16   0.767  -0.627   3.064
  125    HA   GLN  16           HA       GLN  16   3.194  -1.117   4.374
  126    HB2  GLN  16           HB2      GLN  16   0.649  -2.627   4.015
  127    HB3  GLN  16           HB3      GLN  16   2.043  -3.492   4.648
  128    HG2  GLN  16           HG2      GLN  16   0.958  -0.950   5.833
  129    HG3  GLN  16           HG3      GLN  16   0.521  -2.567   6.381
  130   HE21  GLN  16          HE21      GLN  16   2.378  -0.029   7.105
  131   HE22  GLN  16          HE22      GLN  16   3.682  -0.812   7.923
  132    H    MET  17           H        MET  17   1.734  -2.704   1.552
  133    HA   MET  17           HA       MET  17   3.855  -4.558   1.185
  134    HB2  MET  17           HB2      MET  17   1.827  -3.569  -0.827
  135    HB3  MET  17           HB3      MET  17   2.822  -5.010  -0.986
  136    HG2  MET  17           HG2      MET  17   1.070  -4.765   1.398
  137    HG3  MET  17           HG3      MET  17   0.328  -5.129  -0.158
  138    HE1  MET  17           HE1      MET  17   0.486  -7.134   2.641
  139    HE2  MET  17           HE2      MET  17  -0.580  -7.173   1.236
  140    HE3  MET  17           HE3      MET  17   0.377  -8.594   1.657
  141    H    ALA  18           H        ALA  18   3.188  -1.331  -0.034
  142    HA   ALA  18           HA       ALA  18   5.294  -1.332  -1.968
  143    HB1  ALA  18           HB1      ALA  18   4.317   1.242  -0.890
  144    HB2  ALA  18           HB2      ALA  18   4.548   0.722  -2.560
  145    HB3  ALA  18           HB3      ALA  18   3.124   0.197  -1.662
  146    H    VAL  19           H        VAL  19   5.069  -0.663   1.424
  147    HA   VAL  19           HA       VAL  19   7.311   0.994   1.754
  148    HB   VAL  19           HB       VAL  19   5.732  -0.781   3.538
  149   HG11  VAL  19          HG11      VAL  19   7.976  -1.412   4.170
  150   HG12  VAL  19          HG12      VAL  19   8.457   0.283   4.271
  151   HG13  VAL  19          HG13      VAL  19   7.285  -0.372   5.415
  152   HG21  VAL  19          HG21      VAL  19   6.690   2.065   3.820
  153   HG22  VAL  19          HG22      VAL  19   5.144   1.583   3.121
  154   HG23  VAL  19          HG23      VAL  19   5.483   1.255   4.820
  155    H    LYS  20           H        LYS  20   7.013  -2.544   2.004
  156    HA   LYS  20           HA       LYS  20   9.761  -3.003   2.508
  157    HB2  LYS  20           HB2      LYS  20   9.275  -5.304   2.280
  158    HB3  LYS  20           HB3      LYS  20   7.820  -4.585   2.959
  159    HG2  LYS  20           HG2      LYS  20   7.125  -4.423   0.424
  160    HG3  LYS  20           HG3      LYS  20   8.290  -5.739   0.263
  161    HD2  LYS  20           HD2      LYS  20   5.969  -6.526   0.630
  162    HD3  LYS  20           HD3      LYS  20   7.091  -7.062   1.883
  163    HE2  LYS  20           HE2      LYS  20   6.202  -5.633   3.470
  164    HE3  LYS  20           HE3      LYS  20   5.535  -4.538   2.260
  165    HZ1  LYS  20           HZ1      LYS  20   3.993  -6.433   1.671
  166    HZ2  LYS  20           HZ2      LYS  20   3.713  -5.674   3.157
  167    HZ3  LYS  20           HZ3      LYS  20   4.493  -7.175   3.108
  168    H    LYS  21           H        LYS  21   7.829  -2.884  -0.436
  169    HA   LYS  21           HA       LYS  21   9.814  -3.857  -2.196
  170    HB2  LYS  21           HB2      LYS  21   7.554  -1.953  -2.833
  171    HB3  LYS  21           HB3      LYS  21   8.428  -2.962  -3.977
  172    HG2  LYS  21           HG2      LYS  21   7.052  -4.293  -1.708
  173    HG3  LYS  21           HG3      LYS  21   6.070  -3.657  -3.030
  174    HD2  LYS  21           HD2      LYS  21   7.559  -4.929  -4.608
  175    HD3  LYS  21           HD3      LYS  21   8.284  -5.696  -3.193
  176    HE2  LYS  21           HE2      LYS  21   6.578  -7.140  -4.094
  177    HE3  LYS  21           HE3      LYS  21   6.042  -6.510  -2.537
  178    HZ1  LYS  21           HZ1      LYS  21   4.202  -5.895  -3.587
  179    HZ2  LYS  21           HZ2      LYS  21   4.860  -6.203  -5.114
  180    HZ3  LYS  21           HZ3      LYS  21   5.115  -4.705  -4.370
  181    H    TYR  22           H        TYR  22   9.020  -0.632  -1.024
  182    HA   TYR  22           HA       TYR  22  10.807   0.739  -2.773
  183    HB2  TYR  22           HB2      TYR  22   9.295   1.497  -0.292
  184    HB3  TYR  22           HB3      TYR  22  10.495   2.590  -0.972
  185    HD1  TYR  22           HD1      TYR  22   8.143   0.370  -2.804
  186    HD2  TYR  22           HD2      TYR  22   9.180   4.363  -1.762
  187    HE1  TYR  22           HE1      TYR  22   6.465   1.214  -4.392
  188    HE2  TYR  22           HE2      TYR  22   7.504   5.218  -3.346
  189    HH   TYR  22           HH       TYR  22   5.928   4.702  -4.816
  190    H    LEU  23           H        LEU  23  11.021  -0.486   0.531
  191    HA   LEU  23           HA       LEU  23  13.583   0.624   1.077
  192    HB2  LEU  23           HB2      LEU  23  13.407  -0.354   3.118
  193    HB3  LEU  23           HB3      LEU  23  11.709  -0.372   2.647
  194    HG   LEU  23           HG       LEU  23  12.247  -2.767   1.784
  195   HD11  LEU  23          HD11      LEU  23  14.003  -3.550   3.721
  196   HD12  LEU  23          HD12      LEU  23  14.697  -2.018   3.190
  197   HD13  LEU  23          HD13      LEU  23  14.404  -3.305   2.021
  198   HD21  LEU  23          HD21      LEU  23  11.356  -3.623   3.731
  199   HD22  LEU  23          HD22      LEU  23  10.884  -1.927   3.836
  200   HD23  LEU  23          HD23      LEU  23  12.266  -2.516   4.760
  201    H    ASN  24           H        ASN  24  12.460  -2.463  -0.197
  202    HA   ASN  24           HA       ASN  24  14.892  -3.855  -0.096
  203    HB2  ASN  24           HB2      ASN  24  13.812  -5.502  -1.256
  204    HB3  ASN  24           HB3      ASN  24  12.402  -4.566  -0.769
  205   HD21  ASN  24          HD21      ASN  24  14.826  -4.638  -3.360
  206   HD22  ASN  24          HD22      ASN  24  13.710  -4.331  -4.643
  207    H    SER  25           H        SER  25  13.451  -1.930  -2.715
  208    HA   SER  25           HA       SER  25  15.602  -2.282  -4.521
  209    HB2  SER  25           HB2      SER  25  13.510  -1.620  -5.442
  210    HB3  SER  25           HB3      SER  25  13.387  -0.237  -4.354
  211    HG   SER  25           HG       SER  25  14.049   0.366  -6.467
  212    H    ILE  26           H        ILE  26  14.945   0.035  -1.980
  213    HA   ILE  26           HA       ILE  26  16.984   1.888  -2.705
  214    HB   ILE  26           HB       ILE  26  15.473   1.443  -0.138
  215   HG12  ILE  26          HG12      ILE  26  15.424   3.835  -1.971
  216   HG13  ILE  26          HG13      ILE  26  14.388   2.438  -2.240
  217   HG21  ILE  26          HG21      ILE  26  16.669   3.970  -0.055
  218   HG22  ILE  26          HG22      ILE  26  17.036   2.575   0.959
  219   HG23  ILE  26          HG23      ILE  26  17.948   2.851  -0.525
  220   HD11  ILE  26          HD11      ILE  26  13.780   4.627  -0.712
  221   HD12  ILE  26          HD12      ILE  26  12.968   3.063  -0.649
  222   HD13  ILE  26          HD13      ILE  26  14.265   3.430   0.488
  223    H    LEU  27           H        LEU  27  16.804  -0.765  -0.355
  224    HA   LEU  27           HA       LEU  27  19.484  -0.390   0.574
  225    HB2  LEU  27           HB2      LEU  27  17.364  -2.454   0.968
  226    HB3  LEU  27           HB3      LEU  27  19.019  -2.805   1.461
  227    HG   LEU  27           HG       LEU  27  17.437  -0.441   2.460
  228   HD11  LEU  27          HD11      LEU  27  16.768  -2.990   3.011
  229   HD12  LEU  27          HD12      LEU  27  16.579  -1.656   4.149
  230   HD13  LEU  27          HD13      LEU  27  17.989  -2.710   4.253
  231   HD21  LEU  27          HD21      LEU  27  20.054  -1.697   3.261
  232   HD22  LEU  27          HD22      LEU  27  19.183  -0.535   4.263
  233   HD23  LEU  27          HD23      LEU  27  19.774  -0.059   2.670
  234    H    ASN  28           H        ASN  28  17.911  -2.466  -1.793
  235    HA   ASN  28           HA       ASN  28  19.875  -4.316  -2.316
  236    HB2  ASN  28           HB2      ASN  28  17.732  -4.453  -3.412
  237    HB3  ASN  28           HB3      ASN  28  18.011  -2.930  -4.251
  238   HD21  ASN  28          HD21      ASN  28  17.732  -3.863  -6.264
  239   HD22  ASN  28          HD22      ASN  28  18.910  -4.912  -6.969
  240    H    GLY  29           H        GLY  29  19.727  -0.947  -3.305
  241    HA2  GLY  29           HA2      GLY  29  22.381  -1.267  -4.564
  242    HA3  GLY  29           HA3      GLY  29  21.198  -0.069  -5.067
  Start of MODEL   16
    1    H1   HIS   1           H        HIS   1 -25.403   5.559  -0.360
    2    HA   HIS   1           HA       HIS   1 -23.424   4.209   1.176
    3    HB2  HIS   1           HB2      HIS   1 -25.439   3.215  -0.103
    4    HB3  HIS   1           HB3      HIS   1 -24.392   3.283  -1.518
    5    HD1  HIS   1           HD1      HIS   1 -23.307   1.116  -1.940
    6    HD2  HIS   1           HD2      HIS   1 -23.873   1.778   2.122
    7    HE1  HIS   1           HE1      HIS   1 -22.390  -0.925  -0.792
    8    HE2  HIS   1           HE2      HIS   1 -22.821  -0.539   1.660
    9    H    SER   2           H        SER   2 -21.372   4.894   1.058
   10    HA   SER   2           HA       SER   2 -20.182   5.185  -1.624
   11    HB2  SER   2           HB2      SER   2 -20.391   7.264  -0.044
   12    HB3  SER   2           HB3      SER   2 -19.016   6.538   0.788
   13    HG   SER   2           HG       SER   2 -19.149   7.263  -1.954
   14    H    ASP   3           H        ASP   3 -18.434   3.986  -2.084
   15    HA   ASP   3           HA       ASP   3 -17.596   1.995  -0.167
   16    HB2  ASP   3           HB2      ASP   3 -15.997   1.453  -2.200
   17    HB3  ASP   3           HB3      ASP   3 -17.706   1.028  -2.253
   18    H    ALA   4           H        ALA   4 -16.946   4.531   0.736
   19    HA   ALA   4           HA       ALA   4 -14.279   5.283   0.098
   20    HB1  ALA   4           HB1      ALA   4 -14.641   7.037   1.456
   21    HB2  ALA   4           HB2      ALA   4 -16.319   6.495   1.407
   22    HB3  ALA   4           HB3      ALA   4 -15.282   6.031   2.756
   23    H    VAL   5           H        VAL   5 -15.718   3.394   2.733
   24    HA   VAL   5           HA       VAL   5 -13.381   2.991   4.227
   25    HB   VAL   5           HB       VAL   5 -15.601   2.490   5.120
   26   HG11  VAL   5          HG11      VAL   5 -16.896   0.616   4.424
   27   HG12  VAL   5          HG12      VAL   5 -16.486   1.535   2.974
   28   HG13  VAL   5          HG13      VAL   5 -15.614   0.050   3.355
   29   HG21  VAL   5          HG21      VAL   5 -13.630   0.220   5.042
   30   HG22  VAL   5          HG22      VAL   5 -13.828   1.452   6.288
   31   HG23  VAL   5          HG23      VAL   5 -15.058   0.207   6.076
   32    H    PHE   6           H        PHE   6 -14.747   1.205   1.508
   33    HA   PHE   6           HA       PHE   6 -12.992  -0.996   1.599
   34    HB2  PHE   6           HB2      PHE   6 -14.673   0.226  -0.572
   35    HB3  PHE   6           HB3      PHE   6 -13.600  -1.126  -0.917
   36    HD1  PHE   6           HD1      PHE   6 -16.527  -0.054   1.052
   37    HD2  PHE   6           HD2      PHE   6 -14.159  -3.332  -0.277
   38    HE1  PHE   6           HE1      PHE   6 -18.254  -1.618   1.842
   39    HE2  PHE   6           HE2      PHE   6 -15.883  -4.901   0.509
   40    HZ   PHE   6           HZ       PHE   6 -17.934  -4.045   1.570
   41    H    THR   7           H        THR   7 -12.904   1.924  -0.443
   42    HA   THR   7           HA       THR   7 -10.427   1.362  -1.652
   43    HB   THR   7           HB       THR   7 -12.017   3.017  -2.557
   44    HG1  THR   7           HG1      THR   7  -9.554   4.294  -1.929
   45   HG21  THR   7          HG21      THR   7 -12.024   5.303  -1.556
   46   HG22  THR   7          HG22      THR   7 -11.164   4.646  -0.164
   47   HG23  THR   7          HG23      THR   7 -12.790   4.080  -0.543
   48    H    ASP   8           H        ASP   8 -11.275   3.120   1.285
   49    HA   ASP   8           HA       ASP   8  -8.816   4.293   1.852
   50    HB2  ASP   8           HB2      ASP   8 -10.424   5.046   3.301
   51    HB3  ASP   8           HB3      ASP   8 -11.174   3.460   3.462
   52    H    ASN   9           H        ASN   9  -9.974   1.024   2.484
   53    HA   ASN   9           HA       ASN   9  -7.756   0.219   4.065
   54    HB2  ASN   9           HB2      ASN   9 -10.036  -1.144   2.721
   55    HB3  ASN   9           HB3      ASN   9  -8.644  -2.133   3.154
   56   HD21  ASN   9          HD21      ASN   9 -11.276  -0.209   4.330
   57   HD22  ASN   9          HD22      ASN   9 -11.169  -0.703   5.982
   58    H    TYR  10           H        TYR  10  -8.505   0.013   0.620
   59    HA   TYR  10           HA       TYR  10  -6.253  -1.557  -0.088
   60    HB2  TYR  10           HB2      TYR  10  -7.746   0.370  -1.872
   61    HB3  TYR  10           HB3      TYR  10  -6.804  -1.031  -2.368
   62    HD1  TYR  10           HD1      TYR  10  -7.863  -2.926  -0.212
   63    HD2  TYR  10           HD2      TYR  10  -9.814  -0.243  -2.876
   64    HE1  TYR  10           HE1      TYR  10  -9.887  -4.321  -0.125
   65    HE2  TYR  10           HE2      TYR  10 -11.844  -1.630  -2.796
   66    HH   TYR  10           HH       TYR  10 -12.417  -4.025  -2.303
   67    H    THR  11           H        THR  11  -6.867   1.932  -0.097
   68    HA   THR  11           HA       THR  11  -4.477   2.768  -1.272
   69    HB   THR  11           HB       THR  11  -4.850   4.932  -0.108
   70    HG1  THR  11           HG1      THR  11  -5.750   4.443   1.822
   71   HG21  THR  11          HG21      THR  11  -7.574   4.235  -0.993
   72   HG22  THR  11          HG22      THR  11  -6.285   3.852  -2.134
   73   HG23  THR  11          HG23      THR  11  -6.488   5.505  -1.556
   74    H    ARG  12           H        ARG  12  -5.270   2.329   2.170
   75    HA   ARG  12           HA       ARG  12  -2.697   3.049   3.117
   76    HB2  ARG  12           HB2      ARG  12  -5.043   1.610   4.322
   77    HB3  ARG  12           HB3      ARG  12  -3.523   1.734   5.197
   78    HG2  ARG  12           HG2      ARG  12  -3.647   4.140   5.163
   79    HG3  ARG  12           HG3      ARG  12  -5.097   4.081   4.159
   80    HD2  ARG  12           HD2      ARG  12  -6.018   4.382   6.242
   81    HD3  ARG  12           HD3      ARG  12  -6.030   2.623   6.120
   82    HE   ARG  12           HE       ARG  12  -3.671   3.091   7.311
   83   HH11  ARG  12          HH12      ARG  12  -6.888   4.248   7.968
   84   HH12  ARG  12          HH11      ARG  12  -6.623   4.409   9.673
   85   HH21  ARG  12          HH22      ARG  12  -3.310   3.299   9.554
   86   HH22  ARG  12          HH21      ARG  12  -4.587   3.870  10.573
   87    H    LEU  13           H        LEU  13  -4.223  -0.059   2.380
   88    HA   LEU  13           HA       LEU  13  -2.174  -1.727   3.309
   89    HB2  LEU  13           HB2      LEU  13  -4.248  -2.720   2.829
   90    HB3  LEU  13           HB3      LEU  13  -4.280  -2.057   1.197
   91    HG   LEU  13           HG       LEU  13  -2.211  -3.596   0.823
   92   HD11  LEU  13          HD11      LEU  13  -1.668  -4.489   2.860
   93   HD12  LEU  13          HD12      LEU  13  -2.726  -5.750   2.229
   94   HD13  LEU  13          HD13      LEU  13  -3.347  -4.580   3.394
   95   HD21  LEU  13          HD21      LEU  13  -4.683  -3.744  -0.010
   96   HD22  LEU  13          HD22      LEU  13  -4.778  -5.088   1.128
   97   HD23  LEU  13          HD23      LEU  13  -3.602  -5.126  -0.186
   98    H    ARG  14           H        ARG  14  -2.653  -0.143   0.192
   99    HA   ARG  14           HA       ARG  14  -0.616  -1.405  -1.245
  100    HB2  ARG  14           HB2      ARG  14  -2.454   0.253  -2.030
  101    HB3  ARG  14           HB3      ARG  14  -1.279   1.499  -1.631
  102    HG2  ARG  14           HG2      ARG  14  -0.448  -0.758  -3.387
  103    HG3  ARG  14           HG3      ARG  14  -1.444   0.537  -4.054
  104    HD2  ARG  14           HD2      ARG  14   0.983   1.226  -2.462
  105    HD3  ARG  14           HD3      ARG  14   1.170   0.687  -4.130
  106    HE   ARG  14           HE       ARG  14   0.118   3.209  -3.227
  107   HH11  ARG  14          HH12      ARG  14   0.213   0.902  -5.832
  108   HH12  ARG  14          HH11      ARG  14  -0.185   2.067  -7.051
  109   HH21  ARG  14          HH22      ARG  14  -0.408   4.751  -4.823
  110   HH22  ARG  14          HH21      ARG  14  -0.538   4.256  -6.476
  111    H    LYS  15           H        LYS  15  -0.525   1.298   0.999
  112    HA   LYS  15           HA       LYS  15   2.091   2.180   0.461
  113    HB2  LYS  15           HB2      LYS  15   0.367   3.415   1.798
  114    HB3  LYS  15           HB3      LYS  15   0.652   2.287   3.116
  115    HG2  LYS  15           HG2      LYS  15   1.920   4.185   3.637
  116    HG3  LYS  15           HG3      LYS  15   3.081   3.009   3.017
  117    HD2  LYS  15           HD2      LYS  15   2.716   4.146   0.744
  118    HD3  LYS  15           HD3      LYS  15   1.979   5.456   1.670
  119    HE2  LYS  15           HE2      LYS  15   4.729   4.381   2.251
  120    HE3  LYS  15           HE3      LYS  15   4.438   5.711   1.131
  121    HZ1  LYS  15           HZ1      LYS  15   4.893   6.752   3.137
  122    HZ2  LYS  15           HZ2      LYS  15   4.011   5.635   4.050
  123    HZ3  LYS  15           HZ3      LYS  15   3.202   6.765   3.086
  124    H    GLN  16           H        GLN  16   0.839  -0.356   2.551
  125    HA   GLN  16           HA       GLN  16   3.284  -0.885   3.898
  126    HB2  GLN  16           HB2      GLN  16   0.671  -2.297   3.595
  127    HB3  GLN  16           HB3      GLN  16   2.046  -3.200   4.216
  128    HG2  GLN  16           HG2      GLN  16   1.396  -0.565   5.431
  129    HG3  GLN  16           HG3      GLN  16   0.394  -1.960   5.825
  130   HE21  GLN  16          HE21      GLN  16   3.719  -0.792   5.782
  131   HE22  GLN  16          HE22      GLN  16   4.268  -1.763   7.102
  132    H    MET  17           H        MET  17   1.672  -2.401   1.119
  133    HA   MET  17           HA       MET  17   3.700  -4.342   0.685
  134    HB2  MET  17           HB2      MET  17   2.595  -4.500  -1.614
  135    HB3  MET  17           HB3      MET  17   1.590  -4.862  -0.217
  136    HG2  MET  17           HG2      MET  17   0.535  -2.720  -0.339
  137    HG3  MET  17           HG3      MET  17   1.651  -2.192  -1.596
  138    HE1  MET  17           HE1      MET  17  -0.263  -5.894  -1.659
  139    HE2  MET  17           HE2      MET  17  -0.894  -4.715  -0.509
  140    HE3  MET  17           HE3      MET  17  -1.823  -5.125  -1.952
  141    H    ALA  18           H        ALA  18   3.057  -1.138  -0.658
  142    HA   ALA  18           HA       ALA  18   5.181  -1.236  -2.564
  143    HB1  ALA  18           HB1      ALA  18   4.183   1.381  -1.597
  144    HB2  ALA  18           HB2      ALA  18   4.474   0.814  -3.241
  145    HB3  ALA  18           HB3      ALA  18   3.023   0.306  -2.377
  146    H    VAL  19           H        VAL  19   4.916  -0.331   0.783
  147    HA   VAL  19           HA       VAL  19   7.206   1.280   1.019
  148    HB   VAL  19           HB       VAL  19   5.539  -0.289   2.916
  149   HG11  VAL  19          HG11      VAL  19   8.379   0.491   3.404
  150   HG12  VAL  19          HG12      VAL  19   7.212   0.579   4.725
  151   HG13  VAL  19          HG13      VAL  19   7.508  -0.957   3.908
  152   HG21  VAL  19          HG21      VAL  19   4.822   1.737   3.543
  153   HG22  VAL  19          HG22      VAL  19   6.458   2.391   3.628
  154   HG23  VAL  19          HG23      VAL  19   5.616   2.320   2.080
  155    H    LYS  20           H        LYS  20   6.771  -2.217   1.480
  156    HA   LYS  20           HA       LYS  20   9.396  -2.824   2.227
  157    HB2  LYS  20           HB2      LYS  20   7.116  -4.356   1.082
  158    HB3  LYS  20           HB3      LYS  20   8.706  -5.103   1.020
  159    HG2  LYS  20           HG2      LYS  20   8.815  -5.392   3.266
  160    HG3  LYS  20           HG3      LYS  20   7.852  -3.953   3.611
  161    HD2  LYS  20           HD2      LYS  20   6.688  -6.445   2.387
  162    HD3  LYS  20           HD3      LYS  20   6.764  -6.180   4.130
  163    HE2  LYS  20           HE2      LYS  20   5.548  -3.996   3.706
  164    HE3  LYS  20           HE3      LYS  20   5.266  -4.580   2.067
  165    HZ1  LYS  20           HZ1      LYS  20   3.385  -5.081   3.457
  166    HZ2  LYS  20           HZ2      LYS  20   4.364  -5.888   4.576
  167    HZ3  LYS  20           HZ3      LYS  20   4.151  -6.526   3.024
  168    H    LYS  21           H        LYS  21   7.893  -2.657  -0.974
  169    HA   LYS  21           HA       LYS  21  10.034  -3.610  -2.489
  170    HB2  LYS  21           HB2      LYS  21   7.760  -1.741  -3.080
  171    HB3  LYS  21           HB3      LYS  21   8.999  -2.042  -4.292
  172    HG2  LYS  21           HG2      LYS  21   7.581  -4.320  -2.971
  173    HG3  LYS  21           HG3      LYS  21   6.841  -3.452  -4.318
  174    HD2  LYS  21           HD2      LYS  21   8.781  -3.945  -5.713
  175    HD3  LYS  21           HD3      LYS  21   9.551  -4.781  -4.363
  176    HE2  LYS  21           HE2      LYS  21   8.613  -6.481  -5.687
  177    HE3  LYS  21           HE3      LYS  21   7.502  -6.287  -4.332
  178    HZ1  LYS  21           HZ1      LYS  21   6.903  -6.145  -7.030
  179    HZ2  LYS  21           HZ2      LYS  21   6.763  -4.564  -6.446
  180    HZ3  LYS  21           HZ3      LYS  21   5.872  -5.811  -5.731
  181    H    TYR  22           H        TYR  22   9.387  -0.410  -1.185
  182    HA   TYR  22           HA       TYR  22  11.430   0.946  -2.608
  183    HB2  TYR  22           HB2      TYR  22   9.790   1.552  -0.176
  184    HB3  TYR  22           HB3      TYR  22  11.170   2.573  -0.565
  185    HD1  TYR  22           HD1      TYR  22   8.653   0.941  -2.786
  186    HD2  TYR  22           HD2      TYR  22  10.312   4.583  -1.342
  187    HE1  TYR  22           HE1      TYR  22   7.266   2.199  -4.381
  188    HE2  TYR  22           HE2      TYR  22   8.929   5.851  -2.932
  189    HH   TYR  22           HH       TYR  22   6.417   5.064  -4.220
  190    H    LEU  23           H        LEU  23  11.291  -0.392   0.684
  191    HA   LEU  23           HA       LEU  23  13.958   0.283   1.355
  192    HB2  LEU  23           HB2      LEU  23  12.391  -1.992   2.537
  193    HB3  LEU  23           HB3      LEU  23  13.654  -1.027   3.298
  194    HG   LEU  23           HG       LEU  23  10.879  -0.070   2.596
  195   HD11  LEU  23          HD11      LEU  23  10.804   0.132   5.155
  196   HD12  LEU  23          HD12      LEU  23  12.158  -0.997   5.143
  197   HD13  LEU  23          HD13      LEU  23  10.612  -1.468   4.438
  198   HD21  LEU  23          HD21      LEU  23  12.408   1.546   4.443
  199   HD22  LEU  23          HD22      LEU  23  11.554   2.016   2.974
  200   HD23  LEU  23          HD23      LEU  23  13.210   1.414   2.878
  201    H    ASN  24           H        ASN  24  12.476  -2.527  -0.139
  202    HA   ASN  24           HA       ASN  24  14.671  -4.281   0.053
  203    HB2  ASN  24           HB2      ASN  24  12.206  -4.740  -0.649
  204    HB3  ASN  24           HB3      ASN  24  12.767  -4.336  -2.269
  205   HD21  ASN  24          HD21      ASN  24  14.211  -5.694  -3.310
  206   HD22  ASN  24          HD22      ASN  24  14.521  -7.304  -2.764
  207    H    SER  25           H        SER  25  13.624  -2.165  -2.614
  208    HA   SER  25           HA       SER  25  15.871  -2.746  -4.254
  209    HB2  SER  25           HB2      SER  25  13.959  -1.957  -5.393
  210    HB3  SER  25           HB3      SER  25  13.770  -0.586  -4.300
  211    HG   SER  25           HG       SER  25  15.116  -0.700  -6.593
  212    H    ILE  26           H        ILE  26  15.068  -0.052  -2.092
  213    HA   ILE  26           HA       ILE  26  17.317   1.532  -2.597
  214    HB   ILE  26           HB       ILE  26  15.665   1.267  -0.086
  215   HG12  ILE  26          HG12      ILE  26  15.666   3.562  -2.028
  216   HG13  ILE  26          HG13      ILE  26  14.692   2.128  -2.333
  217   HG21  ILE  26          HG21      ILE  26  17.617   3.459  -0.768
  218   HG22  ILE  26          HG22      ILE  26  16.667   3.294   0.709
  219   HG23  ILE  26          HG23      ILE  26  17.953   2.140   0.354
  220   HD11  ILE  26          HD11      ILE  26  14.139   4.362  -0.651
  221   HD12  ILE  26          HD12      ILE  26  13.103   2.998  -1.072
  222   HD13  ILE  26          HD13      ILE  26  14.180   2.891   0.320
  223    H    LEU  27           H        LEU  27  16.781  -0.730   0.111
  224    HA   LEU  27           HA       LEU  27  19.389  -0.567   1.140
  225    HB2  LEU  27           HB2      LEU  27  17.268  -2.687   1.350
  226    HB3  LEU  27           HB3      LEU  27  18.808  -2.793   2.201
  227    HG   LEU  27           HG       LEU  27  17.069  -0.391   2.580
  228   HD11  LEU  27          HD11      LEU  27  15.929  -1.501   4.422
  229   HD12  LEU  27          HD12      LEU  27  16.736  -3.017   4.024
  230   HD13  LEU  27          HD13      LEU  27  15.584  -2.308   2.893
  231   HD21  LEU  27          HD21      LEU  27  18.101  -0.714   4.916
  232   HD22  LEU  27          HD22      LEU  27  19.140  -0.137   3.612
  233   HD23  LEU  27          HD23      LEU  27  19.207  -1.828   4.112
  234    H    ASN  28           H        ASN  28  17.937  -2.718  -1.251
  235    HA   ASN  28           HA       ASN  28  19.878  -4.637  -1.531
  236    HB2  ASN  28           HB2      ASN  28  17.846  -4.801  -2.795
  237    HB3  ASN  28           HB3      ASN  28  18.189  -3.300  -3.650
  238   HD21  ASN  28          HD21      ASN  28  19.821  -6.386  -2.996
  239   HD22  ASN  28          HD22      ASN  28  20.356  -6.639  -4.620
  240    H    GLY  29           H        GLY  29  19.900  -1.328  -2.731
  241    HA2  GLY  29           HA2      GLY  29  21.763  -0.031  -3.239
  242    HA3  GLY  29           HA3      GLY  29  22.772  -1.458  -3.057
  Start of MODEL   17
    1    H1   HIS   1           H        HIS   1 -15.425   2.930  -5.785
    2    HA   HIS   1           HA       HIS   1 -15.579   5.547  -6.098
    3    HB2  HIS   1           HB2      HIS   1 -17.700   3.477  -6.509
    4    HB3  HIS   1           HB3      HIS   1 -18.087   5.169  -6.802
    5    HD1  HIS   1           HD1      HIS   1 -15.406   2.686  -7.874
    6    HD2  HIS   1           HD2      HIS   1 -17.535   5.944  -9.329
    7    HE1  HIS   1           HE1      HIS   1 -14.690   2.940 -10.271
    8    HE2  HIS   1           HE2      HIS   1 -15.927   4.969 -11.106
    9    H    SER   2           H        SER   2 -17.873   3.826  -3.983
   10    HA   SER   2           HA       SER   2 -18.463   6.400  -2.678
   11    HB2  SER   2           HB2      SER   2 -20.155   3.892  -2.804
   12    HB3  SER   2           HB3      SER   2 -20.594   5.378  -1.962
   13    HG   SER   2           HG       SER   2 -20.173   6.329  -4.199
   14    H    ASP   3           H        ASP   3 -18.010   2.935  -2.043
   15    HA   ASP   3           HA       ASP   3 -17.996   3.069   0.750
   16    HB2  ASP   3           HB2      ASP   3 -16.580   1.148  -1.109
   17    HB3  ASP   3           HB3      ASP   3 -16.724   0.919   0.632
   18    H    ALA   4           H        ALA   4 -16.812   4.864   1.428
   19    HA   ALA   4           HA       ALA   4 -14.186   5.478   0.673
   20    HB1  ALA   4           HB1      ALA   4 -14.312   7.156   2.184
   21    HB2  ALA   4           HB2      ALA   4 -16.025   6.737   2.156
   22    HB3  ALA   4           HB3      ALA   4 -14.988   6.122   3.443
   23    H    VAL   5           H        VAL   5 -15.443   3.398   3.232
   24    HA   VAL   5           HA       VAL   5 -12.965   2.907   4.509
   25    HB   VAL   5           HB       VAL   5 -15.101   2.458   5.619
   26   HG11  VAL   5          HG11      VAL   5 -15.473  -0.046   4.048
   27   HG12  VAL   5          HG12      VAL   5 -16.658   0.924   4.925
   28   HG13  VAL   5          HG13      VAL   5 -16.041   1.479   3.368
   29   HG21  VAL   5          HG21      VAL   5 -13.095   0.273   5.289
   30   HG22  VAL   5          HG22      VAL   5 -13.419   1.300   6.685
   31   HG23  VAL   5          HG23      VAL   5 -14.528  -0.009   6.277
   32    H    PHE   6           H        PHE   6 -14.715   1.250   1.924
   33    HA   PHE   6           HA       PHE   6 -13.088  -1.020   1.730
   34    HB2  PHE   6           HB2      PHE   6 -14.938   0.404  -0.138
   35    HB3  PHE   6           HB3      PHE   6 -13.893  -0.858  -0.781
   36    HD1  PHE   6           HD1      PHE   6 -16.180  -0.307   2.117
   37    HD2  PHE   6           HD2      PHE   6 -14.747  -2.981  -0.869
   38    HE1  PHE   6           HE1      PHE   6 -17.780  -2.013   2.882
   39    HE2  PHE   6           HE2      PHE   6 -16.345  -4.690  -0.110
   40    HZ   PHE   6           HZ       PHE   6 -17.865  -4.207   1.767
   41    H    THR   7           H        THR   7 -12.973   1.986  -0.183
   42    HA   THR   7           HA       THR   7 -10.590   1.305  -1.554
   43    HB   THR   7           HB       THR   7 -12.194   2.993  -2.394
   44    HG1  THR   7           HG1      THR   7 -10.485   4.578  -2.918
   45   HG21  THR   7          HG21      THR   7 -12.482   4.020  -0.052
   46   HG22  THR   7          HG22      THR   7 -12.456   5.113  -1.436
   47   HG23  THR   7          HG23      THR   7 -11.022   4.933  -0.425
   48    H    ASP   8           H        ASP   8 -11.248   3.127   1.392
   49    HA   ASP   8           HA       ASP   8  -8.744   4.254   1.823
   50    HB2  ASP   8           HB2      ASP   8 -11.026   3.471   3.564
   51    HB3  ASP   8           HB3      ASP   8  -9.486   3.802   4.353
   52    H    ASN   9           H        ASN   9  -9.920   1.009   2.533
   53    HA   ASN   9           HA       ASN   9  -7.666   0.166   4.027
   54    HB2  ASN   9           HB2      ASN   9  -9.984  -1.167   2.716
   55    HB3  ASN   9           HB3      ASN   9  -8.590  -2.169   3.113
   56   HD21  ASN   9          HD21      ASN   9 -10.328   0.502   4.683
   57   HD22  ASN   9          HD22      ASN   9 -10.523  -0.297   6.202
   58    H    TYR  10           H        TYR  10  -8.525  -0.098   0.602
   59    HA   TYR  10           HA       TYR  10  -6.283  -1.635  -0.167
   60    HB2  TYR  10           HB2      TYR  10  -7.849   0.289  -1.894
   61    HB3  TYR  10           HB3      TYR  10  -6.885  -1.079  -2.439
   62    HD1  TYR  10           HD1      TYR  10  -7.775  -3.130  -0.448
   63    HD2  TYR  10           HD2      TYR  10  -9.986  -0.268  -2.689
   64    HE1  TYR  10           HE1      TYR  10  -9.759  -4.579  -0.329
   65    HE2  TYR  10           HE2      TYR  10 -11.977  -1.709  -2.576
   66    HH   TYR  10           HH       TYR  10 -11.826  -4.950  -1.248
   67    H    THR  11           H        THR  11  -6.908   1.859  -0.243
   68    HA   THR  11           HA       THR  11  -4.523   2.667  -1.440
   69    HB   THR  11           HB       THR  11  -6.105   4.173   0.652
   70    HG1  THR  11           HG1      THR  11  -7.328   3.521  -1.220
   71   HG21  THR  11          HG21      THR  11  -4.471   5.395  -1.546
   72   HG22  THR  11          HG22      THR  11  -3.723   4.938  -0.016
   73   HG23  THR  11          HG23      THR  11  -5.030   6.121  -0.040
   74    H    ARG  12           H        ARG  12  -5.308   2.360   2.019
   75    HA   ARG  12           HA       ARG  12  -2.737   3.099   2.939
   76    HB2  ARG  12           HB2      ARG  12  -4.797   3.162   4.328
   77    HB3  ARG  12           HB3      ARG  12  -4.809   1.404   4.342
   78    HG2  ARG  12           HG2      ARG  12  -2.660   1.392   5.499
   79    HG3  ARG  12           HG3      ARG  12  -2.640   3.157   5.477
   80    HD2  ARG  12           HD2      ARG  12  -4.683   3.199   6.818
   81    HD3  ARG  12           HD3      ARG  12  -4.717   1.436   6.828
   82    HE   ARG  12           HE       ARG  12  -3.058   1.435   8.423
   83   HH11  ARG  12          HH12      ARG  12  -3.424   4.635   7.102
   84   HH12  ARG  12          HH11      ARG  12  -2.414   5.384   8.295
   85   HH21  ARG  12          HH22      ARG  12  -1.727   2.409   9.998
   86   HH22  ARG  12          HH21      ARG  12  -1.449   4.116   9.941
   87    H    LEU  13           H        LEU  13  -4.236  -0.019   2.224
   88    HA   LEU  13           HA       LEU  13  -2.190  -1.663   3.220
   89    HB2  LEU  13           HB2      LEU  13  -4.331  -2.591   2.711
   90    HB3  LEU  13           HB3      LEU  13  -4.206  -2.090   1.026
   91    HG   LEU  13           HG       LEU  13  -2.124  -3.707   1.049
   92   HD11  LEU  13          HD11      LEU  13  -1.917  -4.514   3.166
   93   HD12  LEU  13          HD12      LEU  13  -3.015  -5.726   2.508
   94   HD13  LEU  13          HD13      LEU  13  -3.646  -4.411   3.497
   95   HD21  LEU  13          HD21      LEU  13  -3.416  -4.912  -0.305
   96   HD22  LEU  13          HD22      LEU  13  -4.740  -3.840   0.150
   97   HD23  LEU  13          HD23      LEU  13  -4.502  -5.362   1.010
   98    H    ARG  14           H        ARG  14  -2.647  -0.126   0.079
   99    HA   ARG  14           HA       ARG  14  -0.609  -1.414  -1.331
  100    HB2  ARG  14           HB2      ARG  14  -2.433   0.240  -2.148
  101    HB3  ARG  14           HB3      ARG  14  -1.258   1.487  -1.753
  102    HG2  ARG  14           HG2      ARG  14   0.332   0.009  -3.226
  103    HG3  ARG  14           HG3      ARG  14  -1.194  -0.571  -3.897
  104    HD2  ARG  14           HD2      ARG  14  -1.793   1.552  -4.673
  105    HD3  ARG  14           HD3      ARG  14  -0.624   2.360  -3.629
  106    HE   ARG  14           HE       ARG  14   0.558   0.617  -5.592
  107   HH11  ARG  14          HH12      ARG  14  -0.601   3.830  -4.921
  108   HH12  ARG  14          HH11      ARG  14   0.370   4.578  -6.145
  109   HH21  ARG  14          HH22      ARG  14   1.842   1.589  -7.208
  110   HH22  ARG  14          HH21      ARG  14   1.759   3.302  -7.446
  111    H    LYS  15           H        LYS  15  -0.517   1.314   0.881
  112    HA   LYS  15           HA       LYS  15   2.105   2.180   0.347
  113    HB2  LYS  15           HB2      LYS  15   0.346   3.408   1.677
  114    HB3  LYS  15           HB3      LYS  15   0.695   2.320   3.014
  115    HG2  LYS  15           HG2      LYS  15   2.007   4.111   3.557
  116    HG3  LYS  15           HG3      LYS  15   3.153   3.129   2.641
  117    HD2  LYS  15           HD2      LYS  15   2.266   4.506   0.607
  118    HD3  LYS  15           HD3      LYS  15   1.752   5.648   1.851
  119    HE2  LYS  15           HE2      LYS  15   4.015   5.842   2.665
  120    HE3  LYS  15           HE3      LYS  15   4.560   4.590   1.549
  121    HZ1  LYS  15           HZ1      LYS  15   4.772   7.162   1.016
  122    HZ2  LYS  15           HZ2      LYS  15   3.225   6.903   0.382
  123    HZ3  LYS  15           HZ3      LYS  15   4.537   6.005  -0.196
  124    H    GLN  16           H        GLN  16   0.832  -0.329   2.457
  125    HA   GLN  16           HA       GLN  16   3.268  -0.853   3.822
  126    HB2  GLN  16           HB2      GLN  16   0.631  -2.202   3.555
  127    HB3  GLN  16           HB3      GLN  16   1.986  -3.178   4.106
  128    HG2  GLN  16           HG2      GLN  16   1.263  -0.566   5.391
  129    HG3  GLN  16           HG3      GLN  16   0.543  -2.098   5.883
  130   HE21  GLN  16          HE21      GLN  16   3.462  -0.208   5.756
  131   HE22  GLN  16          HE22      GLN  16   4.360  -1.148   6.894
  132    H    MET  17           H        MET  17   1.663  -2.394   1.053
  133    HA   MET  17           HA       MET  17   3.685  -4.348   0.651
  134    HB2  MET  17           HB2      MET  17   2.589  -4.527  -1.652
  135    HB3  MET  17           HB3      MET  17   1.577  -4.870  -0.255
  136    HG2  MET  17           HG2      MET  17   0.530  -2.727  -0.404
  137    HG3  MET  17           HG3      MET  17   1.653  -2.215  -1.662
  138    HE1  MET  17           HE1      MET  17  -1.960  -4.957  -1.997
  139    HE2  MET  17           HE2      MET  17  -1.067  -4.511  -0.543
  140    HE3  MET  17           HE3      MET  17  -2.063  -3.312  -1.368
  141    H    ALA  18           H        ALA  18   3.065  -1.153  -0.723
  142    HA   ALA  18           HA       ALA  18   5.193  -1.281  -2.623
  143    HB1  ALA  18           HB1      ALA  18   4.214   1.352  -1.682
  144    HB2  ALA  18           HB2      ALA  18   4.497   0.764  -3.321
  145    HB3  ALA  18           HB3      ALA  18   3.044   0.278  -2.449
  146    H    VAL  19           H        VAL  19   4.941  -0.396   0.722
  147    HA   VAL  19           HA       VAL  19   7.216   1.232   0.968
  148    HB   VAL  19           HB       VAL  19   5.579  -0.383   2.851
  149   HG11  VAL  19          HG11      VAL  19   7.158   0.276   4.706
  150   HG12  VAL  19          HG12      VAL  19   7.713  -1.028   3.654
  151   HG13  VAL  19          HG13      VAL  19   8.357   0.602   3.455
  152   HG21  VAL  19          HG21      VAL  19   6.550   2.362   3.410
  153   HG22  VAL  19          HG22      VAL  19   5.427   2.155   2.066
  154   HG23  VAL  19          HG23      VAL  19   4.964   1.643   3.689
  155    H    LYS  20           H        LYS  20   6.822  -2.276   1.381
  156    HA   LYS  20           HA       LYS  20   9.463  -2.860   2.095
  157    HB2  LYS  20           HB2      LYS  20   7.173  -4.399   0.994
  158    HB3  LYS  20           HB3      LYS  20   8.765  -5.131   0.851
  159    HG2  LYS  20           HG2      LYS  20   7.630  -5.884   2.861
  160    HG3  LYS  20           HG3      LYS  20   9.074  -4.952   3.263
  161    HD2  LYS  20           HD2      LYS  20   7.600  -3.985   4.711
  162    HD3  LYS  20           HD3      LYS  20   7.320  -2.961   3.300
  163    HE2  LYS  20           HE2      LYS  20   5.192  -3.600   4.170
  164    HE3  LYS  20           HE3      LYS  20   5.445  -4.485   2.666
  165    HZ1  LYS  20           HZ1      LYS  20   4.724  -5.583   5.035
  166    HZ2  LYS  20           HZ2      LYS  20   6.386  -5.893   4.985
  167    HZ3  LYS  20           HZ3      LYS  20   5.389  -6.428   3.728
  168    H    LYS  21           H        LYS  21   7.942  -2.485  -1.057
  169    HA   LYS  21           HA       LYS  21  10.074  -3.462  -2.621
  170    HB2  LYS  21           HB2      LYS  21   7.985  -1.394  -3.333
  171    HB3  LYS  21           HB3      LYS  21   9.006  -2.252  -4.479
  172    HG2  LYS  21           HG2      LYS  21   7.271  -3.801  -2.613
  173    HG3  LYS  21           HG3      LYS  21   6.566  -3.042  -4.043
  174    HD2  LYS  21           HD2      LYS  21   8.124  -4.239  -5.473
  175    HD3  LYS  21           HD3      LYS  21   8.906  -4.950  -4.059
  176    HE2  LYS  21           HE2      LYS  21   5.972  -5.323  -4.498
  177    HE3  LYS  21           HE3      LYS  21   7.128  -6.314  -5.386
  178    HZ1  LYS  21           HZ1      LYS  21   7.901  -6.298  -2.706
  179    HZ2  LYS  21           HZ2      LYS  21   7.312  -7.600  -3.612
  180    HZ3  LYS  21           HZ3      LYS  21   6.241  -6.621  -2.743
  181    H    TYR  22           H        TYR  22   9.376  -0.294  -1.265
  182    HA   TYR  22           HA       TYR  22  11.391   1.112  -2.689
  183    HB2  TYR  22           HB2      TYR  22   9.728   1.679  -0.263
  184    HB3  TYR  22           HB3      TYR  22  11.090   2.727  -0.643
  185    HD1  TYR  22           HD1      TYR  22   8.595   1.054  -2.861
  186    HD2  TYR  22           HD2      TYR  22  10.217   4.721  -1.439
  187    HE1  TYR  22           HE1      TYR  22   7.190   2.288  -4.458
  188    HE2  TYR  22           HE2      TYR  22   8.816   5.965  -3.032
  189    HH   TYR  22           HH       TYR  22   6.280   4.462  -4.813
  190    H    LEU  23           H        LEU  23  11.264  -0.243   0.596
  191    HA   LEU  23           HA       LEU  23  13.941   0.470   1.242
  192    HB2  LEU  23           HB2      LEU  23  12.405  -1.766   2.524
  193    HB3  LEU  23           HB3      LEU  23  13.633  -0.725   3.240
  194    HG   LEU  23           HG       LEU  23  10.909   0.253   2.402
  195   HD11  LEU  23          HD11      LEU  23  11.840  -1.048   4.910
  196   HD12  LEU  23          HD12      LEU  23  10.282  -1.155   4.091
  197   HD13  LEU  23          HD13      LEU  23  10.692   0.286   5.022
  198   HD21  LEU  23          HD21      LEU  23  11.595   2.274   3.037
  199   HD22  LEU  23          HD22      LEU  23  13.233   1.621   3.025
  200   HD23  LEU  23          HD23      LEU  23  12.305   1.649   4.525
  201    H    ASN  24           H        ASN  24  12.421  -2.383  -0.133
  202    HA   ASN  24           HA       ASN  24  14.578  -4.163   0.107
  203    HB2  ASN  24           HB2      ASN  24  12.671  -5.283  -0.502
  204    HB3  ASN  24           HB3      ASN  24  12.134  -4.002  -1.585
  205   HD21  ASN  24          HD21      ASN  24  12.729  -4.040  -3.704
  206   HD22  ASN  24          HD22      ASN  24  13.574  -5.358  -4.434
  207    H    SER  25           H        SER  25  13.614  -2.093  -2.627
  208    HA   SER  25           HA       SER  25  15.877  -2.756  -4.214
  209    HB2  SER  25           HB2      SER  25  13.787  -1.911  -5.201
  210    HB3  SER  25           HB3      SER  25  14.032  -0.361  -4.397
  211    HG   SER  25           HG       SER  25  15.047   0.108  -6.183
  212    H    ILE  26           H        ILE  26  15.148  -0.160  -1.950
  213    HA   ILE  26           HA       ILE  26  17.413   1.437  -2.511
  214    HB   ILE  26           HB       ILE  26  15.660   1.238  -0.068
  215   HG12  ILE  26          HG12      ILE  26  15.917   3.591  -1.912
  216   HG13  ILE  26          HG13      ILE  26  14.918   2.218  -2.375
  217   HG21  ILE  26          HG21      ILE  26  18.069   2.946  -0.575
  218   HG22  ILE  26          HG22      ILE  26  16.774   3.486   0.491
  219   HG23  ILE  26          HG23      ILE  26  17.656   2.004   0.858
  220   HD11  ILE  26          HD11      ILE  26  13.325   3.432  -1.350
  221   HD12  ILE  26          HD12      ILE  26  13.970   2.642   0.090
  222   HD13  ILE  26          HD13      ILE  26  14.477   4.281  -0.320
  223    H    LEU  27           H        LEU  27  16.796  -0.651   0.320
  224    HA   LEU  27           HA       LEU  27  19.429  -0.576   1.288
  225    HB2  LEU  27           HB2      LEU  27  17.106  -2.412   1.708
  226    HB3  LEU  27           HB3      LEU  27  18.678  -2.800   2.404
  227    HG   LEU  27           HG       LEU  27  17.416  -0.140   2.940
  228   HD11  LEU  27          HD11      LEU  27  15.623  -1.448   3.601
  229   HD12  LEU  27          HD12      LEU  27  16.571  -1.315   5.081
  230   HD13  LEU  27          HD13      LEU  27  16.654  -2.786   4.111
  231   HD21  LEU  27          HD21      LEU  27  19.587  -0.202   3.751
  232   HD22  LEU  27          HD22      LEU  27  19.475  -1.901   4.214
  233   HD23  LEU  27          HD23      LEU  27  18.635  -0.671   5.160
  234    H    ASN  28           H        ASN  28  17.815  -2.776  -0.945
  235    HA   ASN  28           HA       ASN  28  19.568  -4.855  -1.132
  236    HB2  ASN  28           HB2      ASN  28  17.694  -5.050  -2.500
  237    HB3  ASN  28           HB3      ASN  28  17.909  -3.445  -3.193
  238   HD21  ASN  28          HD21      ASN  28  18.011  -3.895  -5.305
  239   HD22  ASN  28          HD22      ASN  28  19.185  -4.929  -6.037
  240    H    GLY  29           H        GLY  29  19.944  -1.624  -2.495
  241    HA2  GLY  29           HA2      GLY  29  22.184  -2.096  -4.108
  242    HA3  GLY  29           HA3      GLY  29  21.766  -0.550  -3.385
  Start of MODEL   18
    1    H1   HIS   1           H        HIS   1 -22.960   7.254  -4.783
    2    HA   HIS   1           HA       HIS   1 -21.332   5.154  -4.079
    3    HB2  HIS   1           HB2      HIS   1 -21.925   5.947  -6.415
    4    HB3  HIS   1           HB3      HIS   1 -20.630   7.129  -6.253
    5    HD1  HIS   1           HD1      HIS   1 -20.731   3.403  -5.459
    6    HD2  HIS   1           HD2      HIS   1 -18.555   6.160  -7.679
    7    HE1  HIS   1           HE1      HIS   1 -18.851   2.096  -6.499
    8    HE2  HIS   1           HE2      HIS   1 -17.499   3.801  -7.768
    9    H    SER   2           H        SER   2 -20.511   5.955  -1.986
   10    HA   SER   2           HA       SER   2 -18.243   7.795  -2.208
   11    HB2  SER   2           HB2      SER   2 -18.283   7.728   0.301
   12    HB3  SER   2           HB3      SER   2 -19.771   8.338  -0.422
   13    HG   SER   2           HG       SER   2 -20.756   6.808   0.604
   14    H    ASP   3           H        ASP   3 -18.981   4.671  -0.653
   15    HA   ASP   3           HA       ASP   3 -17.532   3.040   0.106
   16    HB2  ASP   3           HB2      ASP   3 -16.092   2.282  -2.005
   17    HB3  ASP   3           HB3      ASP   3 -17.827   1.992  -1.908
   18    H    ALA   4           H        ALA   4 -16.529   5.517   0.864
   19    HA   ALA   4           HA       ALA   4 -13.835   5.927   0.085
   20    HB1  ALA   4           HB1      ALA   4 -14.144   7.805   1.222
   21    HB2  ALA   4           HB2      ALA   4 -15.714   7.207   1.760
   22    HB3  ALA   4           HB3      ALA   4 -14.273   6.898   2.729
   23    H    VAL   5           H        VAL   5 -15.329   4.211   2.802
   24    HA   VAL   5           HA       VAL   5 -12.961   3.559   4.168
   25    HB   VAL   5           HB       VAL   5 -15.137   3.335   5.231
   26   HG11  VAL   5          HG11      VAL   5 -15.590   1.097   3.260
   27   HG12  VAL   5          HG12      VAL   5 -16.624   1.447   4.647
   28   HG13  VAL   5          HG13      VAL   5 -16.466   2.625   3.343
   29   HG21  VAL   5          HG21      VAL   5 -13.482   2.044   6.282
   30   HG22  VAL   5          HG22      VAL   5 -14.855   0.951   6.100
   31   HG23  VAL   5          HG23      VAL   5 -13.484   0.837   4.996
   32    H    PHE   6           H        PHE   6 -14.715   1.911   1.585
   33    HA   PHE   6           HA       PHE   6 -13.267  -0.490   1.594
   34    HB2  PHE   6           HB2      PHE   6 -14.825   0.962  -0.530
   35    HB3  PHE   6           HB3      PHE   6 -13.986  -0.544  -0.888
   36    HD1  PHE   6           HD1      PHE   6 -16.689   0.999   1.066
   37    HD2  PHE   6           HD2      PHE   6 -14.814  -2.637  -0.109
   38    HE1  PHE   6           HE1      PHE   6 -18.611  -0.269   1.934
   39    HE2  PHE   6           HE2      PHE   6 -16.733  -3.911   0.756
   40    HZ   PHE   6           HZ       PHE   6 -18.636  -2.727   1.778
   41    H    THR   7           H        THR   7 -12.845   2.389  -0.464
   42    HA   THR   7           HA       THR   7 -10.492   1.466  -1.725
   43    HB   THR   7           HB       THR   7 -11.941   3.292  -2.616
   44    HG1  THR   7           HG1      THR   7  -9.152   3.631  -2.283
   45   HG21  THR   7          HG21      THR   7 -11.628   5.567  -1.770
   46   HG22  THR   7          HG22      THR   7 -10.586   4.952  -0.486
   47   HG23  THR   7          HG23      THR   7 -12.294   4.514  -0.522
   48    H    ASP   8           H        ASP   8 -11.055   3.423   1.154
   49    HA   ASP   8           HA       ASP   8  -8.466   4.317   1.630
   50    HB2  ASP   8           HB2      ASP   8 -10.066   5.272   3.021
   51    HB3  ASP   8           HB3      ASP   8 -10.806   3.720   3.403
   52    H    ASN   9           H        ASN   9  -9.993   1.246   2.481
   53    HA   ASN   9           HA       ASN   9  -7.880   0.229   4.043
   54    HB2  ASN   9           HB2      ASN   9 -10.164  -0.714   4.057
   55    HB3  ASN   9           HB3      ASN   9  -9.922  -1.299   2.414
   56   HD21  ASN   9          HD21      ASN   9 -10.470  -2.717   4.943
   57   HD22  ASN   9          HD22      ASN   9  -9.204  -3.883   5.098
   58    H    TYR  10           H        TYR  10  -8.615  -0.029   0.592
   59    HA   TYR  10           HA       TYR  10  -6.512  -1.806  -0.047
   60    HB2  TYR  10           HB2      TYR  10  -7.788   0.224  -1.887
   61    HB3  TYR  10           HB3      TYR  10  -6.966  -1.262  -2.350
   62    HD1  TYR  10           HD1      TYR  10  -8.178  -3.112  -0.313
   63    HD2  TYR  10           HD2      TYR  10  -9.930  -0.131  -2.793
   64    HE1  TYR  10           HE1      TYR  10 -10.320  -4.320  -0.243
   65    HE2  TYR  10           HE2      TYR  10 -12.076  -1.331  -2.729
   66    HH   TYR  10           HH       TYR  10 -13.247  -2.949  -1.563
   67    H    THR  11           H        THR  11  -6.775   1.730  -0.200
   68    HA   THR  11           HA       THR  11  -4.246   2.239  -1.295
   69    HB   THR  11           HB       THR  11  -4.477   4.515  -0.285
   70    HG1  THR  11           HG1      THR  11  -6.535   4.906   0.772
   71   HG21  THR  11          HG21      THR  11  -6.509   5.130  -1.554
   72   HG22  THR  11          HG22      THR  11  -6.900   3.418  -1.717
   73   HG23  THR  11          HG23      THR  11  -5.441   4.065  -2.466
   74    H    ARG  12           H        ARG  12  -5.302   2.133   2.100
   75    HA   ARG  12           HA       ARG  12  -2.827   2.766   3.252
   76    HB2  ARG  12           HB2      ARG  12  -5.210   1.231   4.271
   77    HB3  ARG  12           HB3      ARG  12  -3.787   1.506   5.267
   78    HG2  ARG  12           HG2      ARG  12  -4.089   3.912   5.061
   79    HG3  ARG  12           HG3      ARG  12  -5.495   3.654   4.026
   80    HD2  ARG  12           HD2      ARG  12  -6.773   2.790   5.780
   81    HD3  ARG  12           HD3      ARG  12  -5.354   2.468   6.775
   82    HE   ARG  12           HE       ARG  12  -5.670   5.250   6.246
   83   HH11  ARG  12          HH12      ARG  12  -6.827   2.631   8.226
   84   HH12  ARG  12          HH11      ARG  12  -7.314   3.660   9.532
   85   HH21  ARG  12          HH22      ARG  12  -6.308   6.616   7.958
   86   HH22  ARG  12          HH21      ARG  12  -7.019   5.927   9.378
   87    H    LEU  13           H        LEU  13  -4.252  -0.352   2.370
   88    HA   LEU  13           HA       LEU  13  -2.177  -1.952   3.436
   89    HB2  LEU  13           HB2      LEU  13  -4.336  -2.897   2.965
   90    HB3  LEU  13           HB3      LEU  13  -4.188  -2.486   1.257
   91    HG   LEU  13           HG       LEU  13  -2.126  -4.084   1.340
   92   HD11  LEU  13          HD11      LEU  13  -3.747  -5.121   3.659
   93   HD12  LEU  13          HD12      LEU  13  -2.170  -4.341   3.790
   94   HD13  LEU  13          HD13      LEU  13  -2.325  -5.879   2.941
   95   HD21  LEU  13          HD21      LEU  13  -3.784  -4.776  -0.074
   96   HD22  LEU  13          HD22      LEU  13  -5.030  -4.714   1.173
   97   HD23  LEU  13          HD23      LEU  13  -3.873  -6.045   1.148
   98    H    ARG  14           H        ARG  14  -2.728  -0.527   0.253
   99    HA   ARG  14           HA       ARG  14  -0.670  -1.801  -1.143
  100    HB2  ARG  14           HB2      ARG  14  -2.576  -0.169  -1.931
  101    HB3  ARG  14           HB3      ARG  14  -1.339   1.060  -1.703
  102    HG2  ARG  14           HG2      ARG  14  -0.633  -1.345  -3.291
  103    HG3  ARG  14           HG3      ARG  14  -1.701  -0.145  -4.021
  104    HD2  ARG  14           HD2      ARG  14   0.152   1.510  -3.087
  105    HD3  ARG  14           HD3      ARG  14   1.156   0.069  -3.238
  106    HE   ARG  14           HE       ARG  14  -0.292   0.437  -5.617
  107   HH11  ARG  14          HH12      ARG  14   2.308   1.877  -3.804
  108   HH12  ARG  14          HH11      ARG  14   3.095   2.531  -5.202
  109   HH21  ARG  14          HH22      ARG  14   0.736   1.293  -7.466
  110   HH22  ARG  14          HH21      ARG  14   2.200   2.198  -7.284
  111    H    LYS  15           H        LYS  15  -0.633   1.014   0.961
  112    HA   LYS  15           HA       LYS  15   1.956   1.932   0.355
  113    HB2  LYS  15           HB2      LYS  15   0.200   3.184   1.643
  114    HB3  LYS  15           HB3      LYS  15   0.546   2.144   3.019
  115    HG2  LYS  15           HG2      LYS  15   1.737   4.147   3.373
  116    HG3  LYS  15           HG3      LYS  15   2.929   2.941   2.882
  117    HD2  LYS  15           HD2      LYS  15   2.405   3.899   0.481
  118    HD3  LYS  15           HD3      LYS  15   1.904   5.317   1.406
  119    HE2  LYS  15           HE2      LYS  15   4.188   5.016   2.605
  120    HE3  LYS  15           HE3      LYS  15   4.606   4.050   1.191
  121    HZ1  LYS  15           HZ1      LYS  15   5.144   5.966   0.235
  122    HZ2  LYS  15           HZ2      LYS  15   4.420   6.887   1.455
  123    HZ3  LYS  15           HZ3      LYS  15   3.491   6.320   0.160
  124    H    GLN  16           H        GLN  16   0.783  -0.519   2.587
  125    HA   GLN  16           HA       GLN  16   3.247  -0.914   3.942
  126    HB2  GLN  16           HB2      GLN  16   0.776  -2.614   3.646
  127    HB3  GLN  16           HB3      GLN  16   2.169  -3.133   4.586
  128    HG2  GLN  16           HG2      GLN  16   0.343  -0.808   5.095
  129    HG3  GLN  16           HG3      GLN  16   0.648  -2.210   6.120
  130   HE21  GLN  16          HE21      GLN  16   3.033  -2.444   6.730
  131   HE22  GLN  16          HE22      GLN  16   3.820  -0.997   7.251
  132    H    MET  17           H        MET  17   1.663  -2.614   1.255
  133    HA   MET  17           HA       MET  17   3.733  -4.526   0.910
  134    HB2  MET  17           HB2      MET  17   2.631  -4.821  -1.376
  135    HB3  MET  17           HB3      MET  17   1.632  -5.131   0.038
  136    HG2  MET  17           HG2      MET  17   0.544  -3.010  -0.190
  137    HG3  MET  17           HG3      MET  17   1.642  -2.539  -1.485
  138    HE1  MET  17           HE1      MET  17  -2.152  -4.551  -1.331
  139    HE2  MET  17           HE2      MET  17  -1.141  -5.994  -1.393
  140    HE3  MET  17           HE3      MET  17  -0.873  -4.782  -0.139
  141    H    ALA  18           H        ALA  18   3.020  -1.407  -0.591
  142    HA   ALA  18           HA       ALA  18   5.148  -1.553  -2.489
  143    HB1  ALA  18           HB1      ALA  18   4.392   0.438  -3.273
  144    HB2  ALA  18           HB2      ALA  18   2.954  -0.049  -2.374
  145    HB3  ALA  18           HB3      ALA  18   4.097   1.089  -1.660
  146    H    VAL  19           H        VAL  19   4.875  -0.537   0.816
  147    HA   VAL  19           HA       VAL  19   7.101   1.166   0.988
  148    HB   VAL  19           HB       VAL  19   5.516  -0.418   2.941
  149   HG11  VAL  19          HG11      VAL  19   8.283   0.631   3.467
  150   HG12  VAL  19          HG12      VAL  19   7.098   0.405   4.755
  151   HG13  VAL  19          HG13      VAL  19   7.636  -0.976   3.798
  152   HG21  VAL  19          HG21      VAL  19   6.417   2.383   3.355
  153   HG22  VAL  19          HG22      VAL  19   5.262   2.067   2.060
  154   HG23  VAL  19          HG23      VAL  19   4.866   1.627   3.722
  155    H    LYS  20           H        LYS  20   6.814  -2.333   1.546
  156    HA   LYS  20           HA       LYS  20   9.467  -2.814   2.281
  157    HB2  LYS  20           HB2      LYS  20   7.226  -4.454   1.228
  158    HB3  LYS  20           HB3      LYS  20   8.840  -5.144   1.106
  159    HG2  LYS  20           HG2      LYS  20   7.722  -5.864   3.140
  160    HG3  LYS  20           HG3      LYS  20   9.145  -4.888   3.509
  161    HD2  LYS  20           HD2      LYS  20   7.653  -3.910   4.930
  162    HD3  LYS  20           HD3      LYS  20   7.343  -2.938   3.489
  163    HE2  LYS  20           HE2      LYS  20   5.234  -3.598   4.383
  164    HE3  LYS  20           HE3      LYS  20   5.505  -4.532   2.913
  165    HZ1  LYS  20           HZ1      LYS  20   5.029  -5.469   5.520
  166    HZ2  LYS  20           HZ2      LYS  20   6.563  -5.989   5.035
  167    HZ3  LYS  20           HZ3      LYS  20   5.207  -6.363   4.095
  168    H    LYS  21           H        LYS  21   7.929  -2.837  -0.913
  169    HA   LYS  21           HA       LYS  21  10.092  -3.726  -2.422
  170    HB2  LYS  21           HB2      LYS  21   7.694  -2.042  -3.000
  171    HB3  LYS  21           HB3      LYS  21   8.959  -2.149  -4.217
  172    HG2  LYS  21           HG2      LYS  21   7.641  -4.560  -2.998
  173    HG3  LYS  21           HG3      LYS  21   7.062  -3.772  -4.468
  174    HD2  LYS  21           HD2      LYS  21   9.935  -4.541  -4.301
  175    HD3  LYS  21           HD3      LYS  21   8.737  -5.810  -4.568
  176    HE2  LYS  21           HE2      LYS  21   9.181  -5.234  -6.733
  177    HE3  LYS  21           HE3      LYS  21   7.862  -4.115  -6.392
  178    HZ1  LYS  21           HZ1      LYS  21  10.157  -2.824  -5.589
  179    HZ2  LYS  21           HZ2      LYS  21   9.239  -2.496  -6.971
  180    HZ3  LYS  21           HZ3      LYS  21  10.560  -3.548  -7.064
  181    H    TYR  22           H        TYR  22   9.339  -0.520  -1.194
  182    HA   TYR  22           HA       TYR  22  11.317   0.874  -2.671
  183    HB2  TYR  22           HB2      TYR  22   9.675   1.479  -0.241
  184    HB3  TYR  22           HB3      TYR  22  11.018   2.537  -0.660
  185    HD1  TYR  22           HD1      TYR  22   8.499   0.777  -2.784
  186    HD2  TYR  22           HD2      TYR  22  10.136   4.495  -1.521
  187    HE1  TYR  22           HE1      TYR  22   7.061   1.951  -4.398
  188    HE2  TYR  22           HE2      TYR  22   8.702   5.680  -3.130
  189    HH   TYR  22           HH       TYR  22   6.947   4.044  -5.579
  190    H    LEU  23           H        LEU  23  11.259  -0.368   0.662
  191    HA   LEU  23           HA       LEU  23  13.884   0.425   1.318
  192    HB2  LEU  23           HB2      LEU  23  12.446  -1.942   2.485
  193    HB3  LEU  23           HB3      LEU  23  13.665  -0.925   3.251
  194    HG   LEU  23           HG       LEU  23  10.818  -0.161   2.612
  195   HD11  LEU  23          HD11      LEU  23  10.740  -1.475   4.525
  196   HD12  LEU  23          HD12      LEU  23  10.864   0.163   5.165
  197   HD13  LEU  23          HD13      LEU  23  12.288  -0.876   5.121
  198   HD21  LEU  23          HD21      LEU  23  12.150   1.699   4.307
  199   HD22  LEU  23          HD22      LEU  23  11.411   1.972   2.729
  200   HD23  LEU  23          HD23      LEU  23  13.104   1.489   2.839
  201    H    ASN  24           H        ASN  24  12.566  -2.555  -0.043
  202    HA   ASN  24           HA       ASN  24  14.897  -4.109   0.084
  203    HB2  ASN  24           HB2      ASN  24  13.095  -5.423  -0.439
  204    HB3  ASN  24           HB3      ASN  24  12.366  -4.199  -1.474
  205   HD21  ASN  24          HD21      ASN  24  12.128  -5.063  -3.405
  206   HD22  ASN  24          HD22      ASN  24  13.337  -5.931  -4.283
  207    H    SER  25           H        SER  25  13.634  -2.057  -2.529
  208    HA   SER  25           HA       SER  25  15.816  -2.537  -4.286
  209    HB2  SER  25           HB2      SER  25  13.712  -0.367  -4.217
  210    HB3  SER  25           HB3      SER  25  14.913  -0.511  -5.500
  211    HG   SER  25           HG       SER  25  14.076  -2.736  -5.722
  212    H    ILE  26           H        ILE  26  15.031   0.085  -2.035
  213    HA   ILE  26           HA       ILE  26  17.213   1.745  -2.643
  214    HB   ILE  26           HB       ILE  26  15.591   1.456  -0.119
  215   HG12  ILE  26          HG12      ILE  26  15.634   3.798  -2.001
  216   HG13  ILE  26          HG13      ILE  26  14.654   2.381  -2.361
  217   HG21  ILE  26          HG21      ILE  26  17.618   3.596  -0.751
  218   HG22  ILE  26          HG22      ILE  26  16.604   3.498   0.688
  219   HG23  ILE  26          HG23      ILE  26  17.853   2.285   0.405
  220   HD11  ILE  26          HD11      ILE  26  13.453   2.670  -0.266
  221   HD12  ILE  26          HD12      ILE  26  14.447   4.078   0.114
  222   HD13  ILE  26          HD13      ILE  26  13.353   4.118  -1.269
  223    H    LEU  27           H        LEU  27  16.812  -0.492   0.111
  224    HA   LEU  27           HA       LEU  27  19.444  -0.262   1.055
  225    HB2  LEU  27           HB2      LEU  27  17.302  -2.329   1.378
  226    HB3  LEU  27           HB3      LEU  27  18.905  -2.580   2.065
  227    HG   LEU  27           HG       LEU  27  17.330  -0.113   2.712
  228   HD11  LEU  27          HD11      LEU  27  17.170  -2.708   4.232
  229   HD12  LEU  27          HD12      LEU  27  15.914  -2.115   3.145
  230   HD13  LEU  27          HD13      LEU  27  16.331  -1.198   4.592
  231   HD21  LEU  27          HD21      LEU  27  19.659  -0.113   3.342
  232   HD22  LEU  27          HD22      LEU  27  19.481  -1.681   4.130
  233   HD23  LEU  27          HD23      LEU  27  18.661  -0.264   4.789
  234    H    ASN  28           H        ASN  28  17.977  -2.461  -1.280
  235    HA   ASN  28           HA       ASN  28  19.969  -4.332  -1.594
  236    HB2  ASN  28           HB2      ASN  28  17.902  -3.177  -3.397
  237    HB3  ASN  28           HB3      ASN  28  19.183  -4.128  -4.144
  238   HD21  ASN  28          HD21      ASN  28  17.845  -5.793  -4.740
  239   HD22  ASN  28          HD22      ASN  28  17.134  -6.881  -3.601
  240    H    GLY  29           H        GLY  29  19.857  -1.029  -2.779
  241    HA2  GLY  29           HA2      GLY  29  21.780  -0.938  -4.701
  242    HA3  GLY  29           HA3      GLY  29  21.583   0.324  -3.494
  Start of MODEL   19
    1    H1   HIS   1           H        HIS   1 -15.098  -3.597  -6.490
    2    HA   HIS   1           HA       HIS   1 -17.639  -2.125  -6.738
    3    HB2  HIS   1           HB2      HIS   1 -16.564  -3.233  -4.148
    4    HB3  HIS   1           HB3      HIS   1 -18.179  -2.612  -4.476
    5    HD1  HIS   1           HD1      HIS   1 -18.903  -4.216  -6.972
    6    HD2  HIS   1           HD2      HIS   1 -17.050  -5.854  -3.634
    7    HE1  HIS   1           HE1      HIS   1 -19.428  -6.675  -7.050
    8    HE2  HIS   1           HE2      HIS   1 -18.368  -7.630  -4.974
    9    H    SER   2           H        SER   2 -17.445   0.001  -6.553
   10    HA   SER   2           HA       SER   2 -14.970   1.103  -5.444
   11    HB2  SER   2           HB2      SER   2 -15.963   1.726  -7.768
   12    HB3  SER   2           HB3      SER   2 -17.077   2.731  -6.839
   13    HG   SER   2           HG       SER   2 -15.457   4.095  -7.091
   14    H    ASP   3           H        ASP   3 -15.104   1.410  -3.310
   15    HA   ASP   3           HA       ASP   3 -17.328   3.034  -2.302
   16    HB2  ASP   3           HB2      ASP   3 -17.468   0.447  -1.826
   17    HB3  ASP   3           HB3      ASP   3 -16.276   0.822  -0.584
   18    H    ALA   4           H        ALA   4 -16.839   4.281  -0.442
   19    HA   ALA   4           HA       ALA   4 -14.291   5.419  -0.404
   20    HB1  ALA   4           HB1      ALA   4 -16.003   5.552   2.031
   21    HB2  ALA   4           HB2      ALA   4 -15.080   6.824   1.228
   22    HB3  ALA   4           HB3      ALA   4 -16.595   6.257   0.527
   23    H    VAL   5           H        VAL   5 -15.765   3.096   1.854
   24    HA   VAL   5           HA       VAL   5 -13.484   2.862   3.519
   25    HB   VAL   5           HB       VAL   5 -15.761   2.227   4.245
   26   HG11  VAL   5          HG11      VAL   5 -15.426  -0.298   2.653
   27   HG12  VAL   5          HG12      VAL   5 -16.865   0.299   3.482
   28   HG13  VAL   5          HG13      VAL   5 -16.291   1.102   2.021
   29   HG21  VAL   5          HG21      VAL   5 -14.867   0.895   5.799
   30   HG22  VAL   5          HG22      VAL   5 -14.434  -0.337   4.614
   31   HG23  VAL   5          HG23      VAL   5 -13.362   1.035   4.891
   32    H    PHE   6           H        PHE   6 -14.650   1.020   0.739
   33    HA   PHE   6           HA       PHE   6 -12.816  -1.091   0.857
   34    HB2  PHE   6           HB2      PHE   6 -14.471   0.133  -1.310
   35    HB3  PHE   6           HB3      PHE   6 -13.229  -1.033  -1.751
   36    HD1  PHE   6           HD1      PHE   6 -15.966  -0.672   0.761
   37    HD2  PHE   6           HD2      PHE   6 -13.878  -3.220  -1.934
   38    HE1  PHE   6           HE1      PHE   6 -17.506  -2.511   1.312
   39    HE2  PHE   6           HE2      PHE   6 -15.415  -5.062  -1.388
   40    HZ   PHE   6           HZ       PHE   6 -17.232  -4.709   0.236
   41    H    THR   7           H        THR   7 -12.674   1.890  -1.092
   42    HA   THR   7           HA       THR   7 -10.052   1.417  -2.057
   43    HB   THR   7           HB       THR   7 -11.690   2.946  -3.154
   44    HG1  THR   7           HG1      THR   7  -9.228   3.070  -3.273
   45   HG21  THR   7          HG21      THR   7 -12.300   4.994  -2.289
   46   HG22  THR   7          HG22      THR   7 -10.883   5.094  -1.243
   47   HG23  THR   7          HG23      THR   7 -12.218   4.023  -0.820
   48    H    ASP   8           H        ASP   8 -11.330   3.209   0.698
   49    HA   ASP   8           HA       ASP   8  -9.039   4.573   1.481
   50    HB2  ASP   8           HB2      ASP   8 -11.486   3.602   2.867
   51    HB3  ASP   8           HB3      ASP   8 -10.126   4.088   3.877
   52    H    ASN   9           H        ASN   9 -10.064   1.268   2.225
   53    HA   ASN   9           HA       ASN   9  -7.893   0.704   3.974
   54    HB2  ASN   9           HB2      ASN   9 -10.170  -0.520   3.726
   55    HB3  ASN   9           HB3      ASN   9  -9.374  -1.407   2.429
   56   HD21  ASN   9          HD21      ASN   9 -10.395  -2.386   4.956
   57   HD22  ASN   9          HD22      ASN   9  -9.057  -3.109   5.776
   58    H    TYR  10           H        TYR  10  -8.435   0.299   0.522
   59    HA   TYR  10           HA       TYR  10  -6.188  -1.308  -0.029
   60    HB2  TYR  10           HB2      TYR  10  -7.565   0.678  -1.849
   61    HB3  TYR  10           HB3      TYR  10  -6.500  -0.627  -2.360
   62    HD1  TYR  10           HD1      TYR  10  -7.680  -2.620  -0.252
   63    HD2  TYR  10           HD2      TYR  10  -9.416  -0.095  -3.204
   64    HE1  TYR  10           HE1      TYR  10  -9.610  -4.137  -0.406
   65    HE2  TYR  10           HE2      TYR  10 -11.351  -1.605  -3.365
   66    HH   TYR  10           HH       TYR  10 -11.927  -4.103  -1.104
   67    H    THR  11           H        THR  11  -6.604   2.156   0.297
   68    HA   THR  11           HA       THR  11  -4.126   2.942  -0.811
   69    HB   THR  11           HB       THR  11  -5.669   4.408   1.333
   70    HG1  THR  11           HG1      THR  11  -7.046   5.022  -0.183
   71   HG21  THR  11          HG21      THR  11  -4.482   6.075  -0.657
   72   HG22  THR  11          HG22      THR  11  -3.253   4.976  -0.029
   73   HG23  THR  11          HG23      THR  11  -4.152   6.017   1.074
   74    H    ARG  12           H        ARG  12  -5.136   2.201   2.504
   75    HA   ARG  12           HA       ARG  12  -2.597   2.810   3.659
   76    HB2  ARG  12           HB2      ARG  12  -3.523   1.649   5.667
   77    HB3  ARG  12           HB3      ARG  12  -4.552   2.935   5.048
   78    HG2  ARG  12           HG2      ARG  12  -5.976   1.281   3.959
   79    HG3  ARG  12           HG3      ARG  12  -4.940  -0.012   4.565
   80    HD2  ARG  12           HD2      ARG  12  -6.049   1.921   6.528
   81    HD3  ARG  12           HD3      ARG  12  -7.151   0.737   5.826
   82    HE   ARG  12           HE       ARG  12  -5.041  -0.763   6.624
   83   HH11  ARG  12          HH12      ARG  12  -7.064   1.581   8.216
   84   HH12  ARG  12          HH11      ARG  12  -6.910   0.847   9.778
   85   HH21  ARG  12          HH22      ARG  12  -4.829  -1.738   8.675
   86   HH22  ARG  12          HH21      ARG  12  -5.637  -1.041  10.038
   87    H    LEU  13           H        LEU  13  -4.230  -0.191   2.708
   88    HA   LEU  13           HA       LEU  13  -2.281  -1.983   3.621
   89    HB2  LEU  13           HB2      LEU  13  -4.501  -2.700   2.967
   90    HB3  LEU  13           HB3      LEU  13  -4.190  -2.220   1.300
   91    HG   LEU  13           HG       LEU  13  -2.237  -3.986   1.526
   92   HD11  LEU  13          HD11      LEU  13  -2.308  -4.829   3.631
   93   HD12  LEU  13          HD12      LEU  13  -3.460  -5.925   2.870
   94   HD13  LEU  13          HD13      LEU  13  -4.041  -4.549   3.808
   95   HD21  LEU  13          HD21      LEU  13  -3.849  -5.713   0.695
   96   HD22  LEU  13          HD22      LEU  13  -3.929  -4.163  -0.142
   97   HD23  LEU  13          HD23      LEU  13  -5.152  -4.582   1.059
   98    H    ARG  14           H        ARG  14  -2.608  -0.265   0.553
   99    HA   ARG  14           HA       ARG  14  -0.570  -1.548  -0.866
  100    HB2  ARG  14           HB2      ARG  14  -2.333   0.209  -1.634
  101    HB3  ARG  14           HB3      ARG  14  -1.107   1.387  -1.183
  102    HG2  ARG  14           HG2      ARG  14   0.411  -0.174  -2.694
  103    HG3  ARG  14           HG3      ARG  14  -1.152  -0.545  -3.426
  104    HD2  ARG  14           HD2      ARG  14  -0.398   1.259  -4.680
  105    HD3  ARG  14           HD3      ARG  14  -1.471   2.012  -3.501
  106    HE   ARG  14           HE       ARG  14   1.221   1.953  -2.579
  107   HH11  ARG  14          HH12      ARG  14  -0.957   3.631  -4.715
  108   HH12  ARG  14          HH11      ARG  14  -0.078   5.123  -4.651
  109   HH21  ARG  14          HH22      ARG  14   2.386   3.911  -2.487
  110   HH22  ARG  14          HH21      ARG  14   1.824   5.281  -3.384
  111    H    LYS  15           H        LYS  15  -0.462   1.097   1.450
  112    HA   LYS  15           HA       LYS  15   2.154   1.969   1.040
  113    HB2  LYS  15           HB2      LYS  15   0.803   3.297   2.438
  114    HB3  LYS  15           HB3      LYS  15   0.372   1.934   3.463
  115    HG2  LYS  15           HG2      LYS  15   1.912   3.458   4.582
  116    HG3  LYS  15           HG3      LYS  15   2.629   1.861   4.355
  117    HD2  LYS  15           HD2      LYS  15   4.289   3.495   3.813
  118    HD3  LYS  15           HD3      LYS  15   3.756   2.747   2.305
  119    HE2  LYS  15           HE2      LYS  15   3.914   5.108   1.951
  120    HE3  LYS  15           HE3      LYS  15   2.206   4.671   1.979
  121    HZ1  LYS  15           HZ1      LYS  15   3.337   5.438   4.535
  122    HZ2  LYS  15           HZ2      LYS  15   1.850   5.847   3.842
  123    HZ3  LYS  15           HZ3      LYS  15   3.251   6.678   3.388
  124    H    GLN  16           H        GLN  16   0.923  -0.600   3.155
  125    HA   GLN  16           HA       GLN  16   3.349  -1.293   4.361
  126    HB2  GLN  16           HB2      GLN  16   0.760  -2.700   3.889
  127    HB3  GLN  16           HB3      GLN  16   2.137  -3.645   4.439
  128    HG2  GLN  16           HG2      GLN  16   1.181  -1.172   5.850
  129    HG3  GLN  16           HG3      GLN  16   0.591  -2.789   6.227
  130   HE21  GLN  16          HE21      GLN  16   2.953  -0.484   6.835
  131   HE22  GLN  16          HE22      GLN  16   4.044  -1.468   7.744
  132    H    MET  17           H        MET  17   1.807  -2.560   1.423
  133    HA   MET  17           HA       MET  17   3.868  -4.430   0.850
  134    HB2  MET  17           HB2      MET  17   1.838  -3.199  -1.023
  135    HB3  MET  17           HB3      MET  17   2.794  -4.640  -1.341
  136    HG2  MET  17           HG2      MET  17   1.079  -4.585   1.084
  137    HG3  MET  17           HG3      MET  17   0.315  -4.790  -0.490
  138    HE1  MET  17           HE1      MET  17   1.132  -7.724   2.156
  139    HE2  MET  17           HE2      MET  17  -0.018  -6.445   1.764
  140    HE3  MET  17           HE3      MET  17  -0.117  -8.004   0.943
  141    H    ALA  18           H        ALA  18   3.280  -1.085  -0.046
  142    HA   ALA  18           HA       ALA  18   5.357  -0.960  -2.006
  143    HB1  ALA  18           HB1      ALA  18   4.446   1.514  -0.653
  144    HB2  ALA  18           HB2      ALA  18   4.689   1.182  -2.368
  145    HB3  ALA  18           HB3      ALA  18   3.243   0.589  -1.551
  146    H    VAL  19           H        VAL  19   5.202  -0.615   1.437
  147    HA   VAL  19           HA       VAL  19   7.498   0.937   1.885
  148    HB   VAL  19           HB       VAL  19   5.889  -0.951   3.517
  149   HG11  VAL  19          HG11      VAL  19   7.477  -0.796   5.395
  150   HG12  VAL  19          HG12      VAL  19   8.132  -1.707   4.033
  151   HG13  VAL  19          HG13      VAL  19   8.653  -0.046   4.316
  152   HG21  VAL  19          HG21      VAL  19   6.100   1.070   5.088
  153   HG22  VAL  19          HG22      VAL  19   6.801   1.901   3.700
  154   HG23  VAL  19          HG23      VAL  19   5.159   1.266   3.610
  155    H    LYS  20           H        LYS  20   7.094  -2.599   1.797
  156    HA   LYS  20           HA       LYS  20   9.834  -3.186   2.208
  157    HB2  LYS  20           HB2      LYS  20   9.273  -5.437   1.768
  158    HB3  LYS  20           HB3      LYS  20   7.849  -4.745   2.533
  159    HG2  LYS  20           HG2      LYS  20   7.142  -4.316   0.027
  160    HG3  LYS  20           HG3      LYS  20   8.251  -5.658  -0.262
  161    HD2  LYS  20           HD2      LYS  20   5.909  -6.389   0.054
  162    HD3  LYS  20           HD3      LYS  20   7.008  -7.066   1.257
  163    HE2  LYS  20           HE2      LYS  20   5.694  -4.508   1.945
  164    HE3  LYS  20           HE3      LYS  20   4.659  -5.933   1.879
  165    HZ1  LYS  20           HZ1      LYS  20   6.511  -5.169   3.879
  166    HZ2  LYS  20           HZ2      LYS  20   6.921  -6.692   3.268
  167    HZ3  LYS  20           HZ3      LYS  20   5.376  -6.423   3.902
  168    H    LYS  21           H        LYS  21   7.871  -2.704  -0.675
  169    HA   LYS  21           HA       LYS  21   9.770  -3.578  -2.567
  170    HB2  LYS  21           HB2      LYS  21   7.455  -1.654  -2.767
  171    HB3  LYS  21           HB3      LYS  21   8.435  -2.111  -4.154
  172    HG2  LYS  21           HG2      LYS  21   7.180  -4.233  -2.475
  173    HG3  LYS  21           HG3      LYS  21   6.206  -3.354  -3.656
  174    HD2  LYS  21           HD2      LYS  21   8.827  -4.604  -4.413
  175    HD3  LYS  21           HD3      LYS  21   7.333  -5.543  -4.398
  176    HE2  LYS  21           HE2      LYS  21   6.327  -4.043  -5.999
  177    HE3  LYS  21           HE3      LYS  21   7.734  -2.982  -5.940
  178    HZ1  LYS  21           HZ1      LYS  21   9.033  -4.509  -7.077
  179    HZ2  LYS  21           HZ2      LYS  21   7.541  -4.630  -7.865
  180    HZ3  LYS  21           HZ3      LYS  21   8.003  -5.809  -6.743
  181    H    TYR  22           H        TYR  22   9.141  -0.418  -1.116
  182    HA   TYR  22           HA       TYR  22  11.042   0.980  -2.715
  183    HB2  TYR  22           HB2      TYR  22   9.466   1.611  -0.250
  184    HB3  TYR  22           HB3      TYR  22  10.800   2.664  -0.708
  185    HD1  TYR  22           HD1      TYR  22   8.158   0.902  -2.684
  186    HD2  TYR  22           HD2      TYR  22   9.975   4.605  -1.640
  187    HE1  TYR  22           HE1      TYR  22   6.685   2.066  -4.273
  188    HE2  TYR  22           HE2      TYR  22   8.506   5.780  -3.225
  189    HH   TYR  22           HH       TYR  22   7.193   4.916  -5.502
  190    H    LEU  23           H        LEU  23  11.083  -0.103   0.681
  191    HA   LEU  23           HA       LEU  23  13.746   0.654   1.192
  192    HB2  LEU  23           HB2      LEU  23  13.551  -0.494   3.217
  193    HB3  LEU  23           HB3      LEU  23  11.921   0.072   2.858
  194    HG   LEU  23           HG       LEU  23  11.663  -2.344   1.841
  195   HD11  LEU  23          HD11      LEU  23  14.212  -2.631   2.528
  196   HD12  LEU  23          HD12      LEU  23  13.067  -3.971   2.573
  197   HD13  LEU  23          HD13      LEU  23  13.475  -3.110   4.057
  198   HD21  LEU  23          HD21      LEU  23  10.872  -3.113   4.062
  199   HD22  LEU  23          HD22      LEU  23  10.297  -1.502   3.632
  200   HD23  LEU  23          HD23      LEU  23  11.621  -1.688   4.784
  201    H    ASN  24           H        ASN  24  12.327  -2.284  -0.107
  202    HA   ASN  24           HA       ASN  24  14.631  -3.909   0.059
  203    HB2  ASN  24           HB2      ASN  24  12.502  -4.958  -0.277
  204    HB3  ASN  24           HB3      ASN  24  12.209  -4.028  -1.744
  205   HD21  ASN  24          HD21      ASN  24  13.726  -4.401  -3.540
  206   HD22  ASN  24          HD22      ASN  24  14.329  -6.003  -3.777
  207    H    SER  25           H        SER  25  13.342  -1.861  -2.534
  208    HA   SER  25           HA       SER  25  15.368  -2.493  -4.415
  209    HB2  SER  25           HB2      SER  25  13.423  -0.191  -4.207
  210    HB3  SER  25           HB3      SER  25  14.557  -0.362  -5.547
  211    HG   SER  25           HG       SER  25  12.366  -1.981  -4.849
  212    H    ILE  26           H        ILE  26  14.928   0.214  -2.163
  213    HA   ILE  26           HA       ILE  26  17.172   1.704  -2.896
  214    HB   ILE  26           HB       ILE  26  15.847   1.463  -0.194
  215   HG12  ILE  26          HG12      ILE  26  15.610   3.701  -2.201
  216   HG13  ILE  26          HG13      ILE  26  14.525   2.315  -2.212
  217   HG21  ILE  26          HG21      ILE  26  17.390   2.802   0.672
  218   HG22  ILE  26          HG22      ILE  26  18.318   2.632  -0.817
  219   HG23  ILE  26          HG23      ILE  26  17.177   3.964  -0.637
  220   HD11  ILE  26          HD11      ILE  26  13.471   2.953  -0.294
  221   HD12  ILE  26          HD12      ILE  26  14.876   3.823   0.322
  222   HD13  ILE  26          HD13      ILE  26  13.896   4.528  -0.964
  223    H    LEU  27           H        LEU  27  16.838  -0.708  -0.294
  224    HA   LEU  27           HA       LEU  27  19.581  -0.635   0.436
  225    HB2  LEU  27           HB2      LEU  27  17.497  -2.760   0.918
  226    HB3  LEU  27           HB3      LEU  27  19.073  -2.682   1.704
  227    HG   LEU  27           HG       LEU  27  17.060  -0.467   1.972
  228   HD11  LEU  27          HD11      LEU  27  17.347  -2.556   4.071
  229   HD12  LEU  27          HD12      LEU  27  16.298  -2.875   2.690
  230   HD13  LEU  27          HD13      LEU  27  15.994  -1.479   3.724
  231   HD21  LEU  27          HD21      LEU  27  18.828   0.446   2.983
  232   HD22  LEU  27          HD22      LEU  27  19.705  -1.084   3.022
  233   HD23  LEU  27          HD23      LEU  27  18.531  -0.707   4.283
  234    H    ASN  28           H        ASN  28  17.670  -2.755  -1.654
  235    HA   ASN  28           HA       ASN  28  19.329  -4.808  -2.212
  236    HB2  ASN  28           HB2      ASN  28  17.266  -4.746  -3.363
  237    HB3  ASN  28           HB3      ASN  28  17.620  -3.177  -4.082
  238   HD21  ASN  28          HD21      ASN  28  17.508  -6.431  -4.626
  239   HD22  ASN  28          HD22      ASN  28  18.500  -6.514  -6.038
  240    H    GLY  29           H        GLY  29  19.682  -1.501  -3.400
  241    HA2  GLY  29           HA2      GLY  29  22.424  -2.197  -4.231
  242    HA3  GLY  29           HA3      GLY  29  21.385  -1.254  -5.290
  Start of MODEL   20
    1    H1   HIS   1           H        HIS   1 -18.547   9.220   0.154
    2    HA   HIS   1           HA       HIS   1 -18.116   9.605   2.878
    3    HB2  HIS   1           HB2      HIS   1 -20.770   8.718   1.770
    4    HB3  HIS   1           HB3      HIS   1 -20.452   9.831   3.097
    5    HD1  HIS   1           HD1      HIS   1 -22.282  10.592   0.714
    6    HD2  HIS   1           HD2      HIS   1 -18.245  11.532   0.989
    7    HE1  HIS   1           HE1      HIS   1 -21.953  12.586  -0.783
    8    HE2  HIS   1           HE2      HIS   1 -19.487  13.084  -0.667
    9    H    SER   2           H        SER   2 -19.400   6.761   1.179
   10    HA   SER   2           HA       SER   2 -19.085   5.217   3.665
   11    HB2  SER   2           HB2      SER   2 -21.344   5.387   2.320
   12    HB3  SER   2           HB3      SER   2 -20.589   4.165   1.298
   13    HG   SER   2           HG       SER   2 -20.837   3.946   4.115
   14    H    ASP   3           H        ASP   3 -18.789   4.779   0.136
   15    HA   ASP   3           HA       ASP   3 -17.241   2.454   0.228
   16    HB2  ASP   3           HB2      ASP   3 -18.254   3.030  -1.842
   17    HB3  ASP   3           HB3      ASP   3 -17.499   4.621  -1.853
   18    H    ALA   4           H        ALA   4 -16.425   5.630   1.070
   19    HA   ALA   4           HA       ALA   4 -13.788   5.938   0.344
   20    HB1  ALA   4           HB1      ALA   4 -13.860   6.905   2.939
   21    HB2  ALA   4           HB2      ALA   4 -14.251   7.802   1.470
   22    HB3  ALA   4           HB3      ALA   4 -15.533   7.015   2.390
   23    H    VAL   5           H        VAL   5 -15.113   4.056   3.027
   24    HA   VAL   5           HA       VAL   5 -12.666   3.389   4.250
   25    HB   VAL   5           HB       VAL   5 -14.836   3.081   5.363
   26   HG11  VAL   5          HG11      VAL   5 -15.817   2.095   3.137
   27   HG12  VAL   5          HG12      VAL   5 -15.310   0.561   3.846
   28   HG13  VAL   5          HG13      VAL   5 -16.454   1.594   4.704
   29   HG21  VAL   5          HG21      VAL   5 -13.304   0.498   5.079
   30   HG22  VAL   5          HG22      VAL   5 -12.852   1.841   6.129
   31   HG23  VAL   5          HG23      VAL   5 -14.347   0.954   6.426
   32    H    PHE   6           H        PHE   6 -14.520   1.847   1.672
   33    HA   PHE   6           HA       PHE   6 -13.057  -0.533   1.484
   34    HB2  PHE   6           HB2      PHE   6 -14.793   1.018  -0.391
   35    HB3  PHE   6           HB3      PHE   6 -13.838  -0.316  -1.030
   36    HD1  PHE   6           HD1      PHE   6 -16.106   0.408   1.844
   37    HD2  PHE   6           HD2      PHE   6 -14.827  -2.382  -1.105
   38    HE1  PHE   6           HE1      PHE   6 -17.827  -1.179   2.603
   39    HE2  PHE   6           HE2      PHE   6 -16.546  -3.972  -0.352
   40    HZ   PHE   6           HZ       PHE   6 -18.050  -3.371   1.504
   41    H    THR   7           H        THR   7 -12.722   2.457  -0.429
   42    HA   THR   7           HA       THR   7 -10.386   1.608  -1.788
   43    HB   THR   7           HB       THR   7 -11.869   3.403  -2.635
   44    HG1  THR   7           HG1      THR   7  -9.180   4.247  -2.188
   45   HG21  THR   7          HG21      THR   7 -12.274   4.519  -0.467
   46   HG22  THR   7          HG22      THR   7 -11.733   5.644  -1.713
   47   HG23  THR   7          HG23      THR   7 -10.607   5.092  -0.473
   48    H    ASP   8           H        ASP   8 -10.930   3.477   1.151
   49    HA   ASP   8           HA       ASP   8  -8.356   4.428   1.592
   50    HB2  ASP   8           HB2      ASP   8 -10.694   3.809   3.324
   51    HB3  ASP   8           HB3      ASP   8  -9.139   4.034   4.120
   52    H    ASN   9           H        ASN   9  -9.805   1.348   2.614
   53    HA   ASN   9           HA       ASN   9  -7.585   0.351   3.999
   54    HB2  ASN   9           HB2      ASN   9  -9.912  -0.973   2.623
   55    HB3  ASN   9           HB3      ASN   9  -8.646  -1.927   3.391
   56   HD21  ASN   9          HD21      ASN   9 -11.617  -1.050   3.893
   57   HD22  ASN   9          HD22      ASN   9 -11.625  -0.765   5.597
   58    H    TYR  10           H        TYR  10  -8.423   0.275   0.585
   59    HA   TYR  10           HA       TYR  10  -6.344  -1.532  -0.166
   60    HB2  TYR  10           HB2      TYR  10  -7.809   0.452  -1.914
   61    HB3  TYR  10           HB3      TYR  10  -6.931  -0.976  -2.448
   62    HD1  TYR  10           HD1      TYR  10  -7.945  -2.870  -0.295
   63    HD2  TYR  10           HD2      TYR  10  -9.949  -0.067  -2.790
   64    HE1  TYR  10           HE1      TYR  10 -10.005  -4.203  -0.126
   65    HE2  TYR  10           HE2      TYR  10 -12.015  -1.391  -2.628
   66    HH   TYR  10           HH       TYR  10 -12.897  -3.194  -0.667
   67    H    THR  11           H        THR  11  -6.709   1.990  -0.213
   68    HA   THR  11           HA       THR  11  -4.248   2.564  -1.467
   69    HB   THR  11           HB       THR  11  -5.778   4.311   0.471
   70    HG1  THR  11           HG1      THR  11  -7.185   3.994  -1.152
   71   HG21  THR  11          HG21      THR  11  -4.693   6.136  -0.916
   72   HG22  THR  11          HG22      THR  11  -3.636   4.884  -1.568
   73   HG23  THR  11          HG23      THR  11  -3.620   5.241   0.159
   74    H    ARG  12           H        ARG  12  -5.170   2.293   1.943
   75    HA   ARG  12           HA       ARG  12  -2.593   3.011   2.938
   76    HB2  ARG  12           HB2      ARG  12  -3.450   2.285   5.109
   77    HB3  ARG  12           HB3      ARG  12  -4.622   3.301   4.282
   78    HG2  ARG  12           HG2      ARG  12  -6.010   1.662   5.004
   79    HG3  ARG  12           HG3      ARG  12  -5.528   0.952   3.462
   80    HD2  ARG  12           HD2      ARG  12  -5.216  -0.816   4.907
   81    HD3  ARG  12           HD3      ARG  12  -3.605  -0.103   4.864
   82    HE   ARG  12           HE       ARG  12  -3.816   0.362   7.085
   83   HH11  ARG  12          HH12      ARG  12  -6.993  -0.111   5.743
   84   HH12  ARG  12          HH11      ARG  12  -7.798  -0.002   7.274
   85   HH21  ARG  12          HH22      ARG  12  -4.864   0.507   9.106
   86   HH22  ARG  12          HH21      ARG  12  -6.586   0.351   9.186
   87    H    LEU  13           H        LEU  13  -4.289  -0.065   2.448
   88    HA   LEU  13           HA       LEU  13  -2.334  -1.748   3.537
   89    HB2  LEU  13           HB2      LEU  13  -4.479  -2.644   3.124
   90    HB3  LEU  13           HB3      LEU  13  -4.431  -2.171   1.427
   91    HG   LEU  13           HG       LEU  13  -2.411  -3.870   1.367
   92   HD11  LEU  13          HD11      LEU  13  -2.096  -4.818   3.371
   93   HD12  LEU  13          HD12      LEU  13  -3.498  -5.800   2.946
   94   HD13  LEU  13          HD13      LEU  13  -3.699  -4.364   3.950
   95   HD21  LEU  13          HD21      LEU  13  -4.355  -5.690   1.129
   96   HD22  LEU  13          HD22      LEU  13  -4.051  -4.446  -0.084
   97   HD23  LEU  13          HD23      LEU  13  -5.336  -4.224   1.105
   98    H    ARG  14           H        ARG  14  -2.758  -0.507   0.250
   99    HA   ARG  14           HA       ARG  14  -0.747  -1.984  -1.007
  100    HB2  ARG  14           HB2      ARG  14  -2.537  -0.413  -2.017
  101    HB3  ARG  14           HB3      ARG  14  -1.361   0.865  -1.742
  102    HG2  ARG  14           HG2      ARG  14   0.266  -0.585  -3.069
  103    HG3  ARG  14           HG3      ARG  14  -1.157  -1.503  -3.567
  104    HD2  ARG  14           HD2      ARG  14  -2.091   0.879  -4.153
  105    HD3  ARG  14           HD3      ARG  14  -0.381   1.304  -4.206
  106    HE   ARG  14           HE       ARG  14  -0.210   0.174  -6.182
  107   HH11  ARG  14          HH12      ARG  14  -3.107  -0.853  -4.548
  108   HH12  ARG  14          HH11      ARG  14  -3.672  -1.812  -5.876
  109   HH21  ARG  14          HH22      ARG  14  -0.943  -1.086  -7.937
  110   HH22  ARG  14          HH21      ARG  14  -2.440  -1.944  -7.803
  111    H    LYS  15           H        LYS  15  -0.599   0.972   0.887
  112    HA   LYS  15           HA       LYS  15   2.037   1.723   0.259
  113    HB2  LYS  15           HB2      LYS  15   0.356   3.160   1.421
  114    HB3  LYS  15           HB3      LYS  15   0.577   2.182   2.866
  115    HG2  LYS  15           HG2      LYS  15   1.907   4.076   3.198
  116    HG3  LYS  15           HG3      LYS  15   3.036   2.804   2.727
  117    HD2  LYS  15           HD2      LYS  15   2.687   3.714   0.329
  118    HD3  LYS  15           HD3      LYS  15   2.061   5.152   1.140
  119    HE2  LYS  15           HE2      LYS  15   4.301   4.877   2.532
  120    HE3  LYS  15           HE3      LYS  15   4.821   4.053   1.063
  121    HZ1  LYS  15           HZ1      LYS  15   3.609   6.325   0.165
  122    HZ2  LYS  15           HZ2      LYS  15   5.277   6.070   0.287
  123    HZ3  LYS  15           HZ3      LYS  15   4.447   6.846   1.540
  124    H    GLN  16           H        GLN  16   0.726  -0.517   2.631
  125    HA   GLN  16           HA       GLN  16   3.156  -0.932   4.043
  126    HB2  GLN  16           HB2      GLN  16   0.504  -2.287   3.916
  127    HB3  GLN  16           HB3      GLN  16   1.852  -3.172   4.616
  128    HG2  GLN  16           HG2      GLN  16   1.250  -0.400   5.540
  129    HG3  GLN  16           HG3      GLN  16   0.298  -1.759   6.134
  130   HE21  GLN  16          HE21      GLN  16   3.475  -0.321   6.008
  131   HE22  GLN  16          HE22      GLN  16   4.143  -1.206   7.333
  132    H    MET  17           H        MET  17   1.509  -2.741   1.466
  133    HA   MET  17           HA       MET  17   3.494  -4.764   1.277
  134    HB2  MET  17           HB2      MET  17   2.383  -5.176  -0.988
  135    HB3  MET  17           HB3      MET  17   1.374  -5.347   0.442
  136    HG2  MET  17           HG2      MET  17   0.358  -3.219   0.063
  137    HG3  MET  17           HG3      MET  17   1.484  -2.862  -1.244
  138    HE1  MET  17           HE1      MET  17   0.754  -3.779  -4.017
  139    HE2  MET  17           HE2      MET  17   1.899  -4.664  -3.008
  140    HE3  MET  17           HE3      MET  17   0.614  -5.530  -3.852
  141    H    ALA  18           H        ALA  18   2.930  -1.724  -0.429
  142    HA   ALA  18           HA       ALA  18   5.037  -2.102  -2.320
  143    HB1  ALA  18           HB1      ALA  18   4.120   0.637  -1.654
  144    HB2  ALA  18           HB2      ALA  18   4.383  -0.122  -3.224
  145    HB3  ALA  18           HB3      ALA  18   2.925  -0.486  -2.303
  146    H    VAL  19           H        VAL  19   4.845  -0.893   0.920
  147    HA   VAL  19           HA       VAL  19   7.133   0.726   0.993
  148    HB   VAL  19           HB       VAL  19   5.529  -0.725   3.033
  149   HG11  VAL  19          HG11      VAL  19   8.325   0.285   3.488
  150   HG12  VAL  19          HG12      VAL  19   7.151   0.101   4.793
  151   HG13  VAL  19          HG13      VAL  19   7.663  -1.307   3.861
  152   HG21  VAL  19          HG21      VAL  19   4.848   1.341   3.605
  153   HG22  VAL  19          HG22      VAL  19   6.468   2.025   3.472
  154   HG23  VAL  19          HG23      VAL  19   5.488   1.793   2.024
  155    H    LYS  20           H        LYS  20   6.722  -2.755   1.379
  156    HA   LYS  20           HA       LYS  20   9.357  -3.325   2.225
  157    HB2  LYS  20           HB2      LYS  20   7.072  -4.890   1.145
  158    HB3  LYS  20           HB3      LYS  20   8.664  -5.633   1.059
  159    HG2  LYS  20           HG2      LYS  20   7.913  -6.406   3.079
  160    HG3  LYS  20           HG3      LYS  20   8.800  -4.963   3.576
  161    HD2  LYS  20           HD2      LYS  20   6.612  -5.136   4.687
  162    HD3  LYS  20           HD3      LYS  20   6.732  -3.694   3.676
  163    HE2  LYS  20           HE2      LYS  20   5.324  -4.578   2.042
  164    HE3  LYS  20           HE3      LYS  20   5.554  -6.233   2.604
  165    HZ1  LYS  20           HZ1      LYS  20   4.110  -4.120   4.110
  166    HZ2  LYS  20           HZ2      LYS  20   4.264  -5.744   4.558
  167    HZ3  LYS  20           HZ3      LYS  20   3.366  -5.326   3.186
  168    H    LYS  21           H        LYS  21   7.846  -3.178  -0.966
  169    HA   LYS  21           HA       LYS  21  10.053  -4.140  -2.436
  170    HB2  LYS  21           HB2      LYS  21   7.586  -3.780  -3.164
  171    HB3  LYS  21           HB3      LYS  21   8.099  -2.139  -3.535
  172    HG2  LYS  21           HG2      LYS  21   8.254  -3.327  -5.552
  173    HG3  LYS  21           HG3      LYS  21   9.912  -3.175  -4.966
  174    HD2  LYS  21           HD2      LYS  21   9.814  -5.401  -5.599
  175    HD3  LYS  21           HD3      LYS  21   9.463  -5.488  -3.871
  176    HE2  LYS  21           HE2      LYS  21   7.200  -5.189  -5.786
  177    HE3  LYS  21           HE3      LYS  21   7.979  -6.763  -5.635
  178    HZ1  LYS  21           HZ1      LYS  21   6.888  -7.122  -3.759
  179    HZ2  LYS  21           HZ2      LYS  21   6.049  -5.669  -3.974
  180    HZ3  LYS  21           HZ3      LYS  21   7.480  -5.693  -3.072
  181    H    TYR  22           H        TYR  22   9.108  -0.905  -1.399
  182    HA   TYR  22           HA       TYR  22  11.110   0.475  -2.867
  183    HB2  TYR  22           HB2      TYR  22   9.292   1.180  -0.593
  184    HB3  TYR  22           HB3      TYR  22  10.605   2.270  -1.024
  185    HD1  TYR  22           HD1      TYR  22   8.345   0.213  -3.167
  186    HD2  TYR  22           HD2      TYR  22   9.641   4.110  -2.054
  187    HE1  TYR  22           HE1      TYR  22   6.951   1.179  -4.948
  188    HE2  TYR  22           HE2      TYR  22   8.249   5.087  -3.831
  189    HH   TYR  22           HH       TYR  22   7.262   4.352  -6.009
  190    H    LEU  23           H        LEU  23  10.867  -0.391   0.582
  191    HA   LEU  23           HA       LEU  23  13.384   0.544   1.351
  192    HB2  LEU  23           HB2      LEU  23  12.991  -0.450   3.368
  193    HB3  LEU  23           HB3      LEU  23  11.351  -0.363   2.727
  194    HG   LEU  23           HG       LEU  23  11.821  -2.787   1.911
  195   HD11  LEU  23          HD11      LEU  23  13.644  -3.850   2.620
  196   HD12  LEU  23          HD12      LEU  23  13.474  -3.223   4.259
  197   HD13  LEU  23          HD13      LEU  23  14.285  -2.258   3.026
  198   HD21  LEU  23          HD21      LEU  23  11.551  -2.462   4.878
  199   HD22  LEU  23          HD22      LEU  23  10.751  -3.613   3.807
  200   HD23  LEU  23          HD23      LEU  23  10.285  -1.912   3.780
  201    H    ASN  24           H        ASN  24  12.401  -2.488  -0.112
  202    HA   ASN  24           HA       ASN  24  14.818  -3.895   0.322
  203    HB2  ASN  24           HB2      ASN  24  12.987  -5.250  -0.226
  204    HB3  ASN  24           HB3      ASN  24  12.517  -4.230  -1.582
  205   HD21  ASN  24          HD21      ASN  24  13.133  -4.815  -3.546
  206   HD22  ASN  24          HD22      ASN  24  14.312  -6.025  -3.910
  207    H    SER  25           H        SER  25  13.616  -1.973  -2.406
  208    HA   SER  25           HA       SER  25  15.900  -2.393  -4.044
  209    HB2  SER  25           HB2      SER  25  13.843  -0.173  -4.146
  210    HB3  SER  25           HB3      SER  25  14.988  -0.573  -5.426
  211    HG   SER  25           HG       SER  25  13.110  -2.427  -4.395
  212    H    ILE  26           H        ILE  26  14.868   0.320  -1.991
  213    HA   ILE  26           HA       ILE  26  16.948   2.073  -2.466
  214    HB   ILE  26           HB       ILE  26  15.517   1.583   0.148
  215   HG12  ILE  26          HG12      ILE  26  14.980   3.874  -1.702
  216   HG13  ILE  26          HG13      ILE  26  14.294   2.297  -2.075
  217   HG21  ILE  26          HG21      ILE  26  17.808   3.066  -0.239
  218   HG22  ILE  26          HG22      ILE  26  16.521   4.267  -0.339
  219   HG23  ILE  26          HG23      ILE  26  16.665   3.247   1.092
  220   HD11  ILE  26          HD11      ILE  26  12.956   2.297  -0.181
  221   HD12  ILE  26          HD12      ILE  26  13.923   3.536   0.620
  222   HD13  ILE  26          HD13      ILE  26  12.886   3.968  -0.739
  223    H    LEU  27           H        LEU  27  16.798  -0.540  -0.062
  224    HA   LEU  27           HA       LEU  27  19.363  -0.078   1.029
  225    HB2  LEU  27           HB2      LEU  27  17.424  -2.343   1.064
  226    HB3  LEU  27           HB3      LEU  27  19.065  -2.610   1.650
  227    HG   LEU  27           HG       LEU  27  17.481  -0.331   2.750
  228   HD11  LEU  27          HD11      LEU  27  16.270  -2.714   2.720
  229   HD12  LEU  27          HD12      LEU  27  16.134  -1.582   4.065
  230   HD13  LEU  27          HD13      LEU  27  17.276  -2.923   4.154
  231   HD21  LEU  27          HD21      LEU  27  18.810  -0.792   4.726
  232   HD22  LEU  27          HD22      LEU  27  19.857  -0.614   3.318
  233   HD23  LEU  27          HD23      LEU  27  19.501  -2.220   3.956
  234    H    ASN  28           H        ASN  28  18.203  -2.173  -1.570
  235    HA   ASN  28           HA       ASN  28  20.420  -3.712  -2.067
  236    HB2  ASN  28           HB2      ASN  28  18.409  -2.493  -3.952
  237    HB3  ASN  28           HB3      ASN  28  19.681  -3.570  -4.521
  238   HD21  ASN  28          HD21      ASN  28  17.678  -4.743  -5.198
  239   HD22  ASN  28          HD22      ASN  28  17.014  -5.879  -4.078
  240    H    GLY  29           H        GLY  29  19.857  -0.351  -2.975
  241    HA2  GLY  29           HA2      GLY  29  22.246   0.745  -2.872
  242    HA3  GLY  29           HA3      GLY  29  22.456  -0.235  -4.316